程道建头像

程道建
  • 个人概况
  • 研究领域
  • 开授课程
  • 科研项目
  • 论文信息
  • 科技成果
  • 荣誉及奖励
  • 招生信息
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研究方向 ：
教授 化工学院院长
部门 ： 化学工程学院
学历： 博士研究生毕业
ORCID：
DBLP：

个人简介

程道建教授主要从事化工领域金属合金纳米催化剂的理论设计、实验验证和应用研究。提出了基于“结构描述符”的催化剂设计新方法，自主开发了“金属合金纳米催化剂智能计算设计平台”，已成功应用于电催化剂、石油化工催化剂和环境催化剂的设计。近年来在Nature Catalysis，Nature Energy， PNAS，ACS Catal.，Adv. Energy Mater.等国际主流期刊，以及Ind. Eng. Chem. Res. 等国际化工主流刊物发表SCI论文150余篇，其中第一或通讯作者论文135篇，总被SCI引用近3000次，H-Index为27，授权或申请专利30余项。获国家自然科学基金优秀青年基金；获北京市优秀博士论文与全国优秀博士论文提名；入选北京市科技新星及北京市青年英才计划；获全球华人化工学者研讨会优秀青年奖。

教育经历

入学时间 毕业时间 学位授予单位 学历
2004-09-01 2008-07-01 北京化工大学 博士研究生毕业
2000-09-01 2004-07-01 北京化工大学

工作经历

起始年月 截止年月 所在单位名称
2023-08-01 至今 北京化工大学
2010-12-01 至今 化学工程学院
2023-08-08 至今 北京化工大学

社会职务

英国皇家化学会会士（Fellow of the Royal Society of Chemistry, FRSC）；

兼任SCI期刊Molecular Simulation区域主编；

兼任SCI期刊Journal of Experimental Nanoscience区域主编；

中国化工学会稀土催化与过程专委会副主任委员；

石化联合会工业催化联盟青年工作委员会委员

中国石油化工催化剂评价试验基地技术委员会委员


社会活动

研究领域

面向石油化工、精细化工和能源化工应用的金属纳米催化剂的设计、制备和应用

本科生

课程名称 开课学年 课程总学时 选课人数 课程性质
工业催化基础 2023 24 89 专业选修
新能源材料分子设计 2023 32 67 素质教育课程
工业催化原理 2023 32 100 专业必修
工业催化基础 2022 24 89 专业选修
化工计算机数据与图形处理 2022 48 103 专业选修
新能源材料分子设计 2022 32 67 素质教育课程
绿色大化工学科前沿 2022 16 38 公共基础必修
绿色大化工学科前沿 2022 16 1 公共基础选修
工业催化基础 2021 24 133 专业选修
化工计算机数据与图形处理 2021 48 92 专业选修
工业催化基础 2020 24 120 专业选修
人工智能导论 2020 32 63 专业必修
化工计算机数据与图形处理 2020 48 96 专业选修
化工计算机数据与图形处理 2019 48 95 专业选修

研究生

课程名称 开课学年 总学时 开课方式
工业催化剂的研发、制备与应用 2024 32
催化理论与计算 2024 32 C专业方向及特色课
催化理论与计算 2023 32 C专业方向及特色课

校级项目

  • 1. 金属合金纳米粒子催化剂协同催化CO氧化的构效关系研究 ，化学工程学院，项目时间： 至 2017-12-31
  • 2. 铜基双金属纳米簇催化CO2加氢制甲醇反应机理的DFT研究及催化剂的计算设计 ，化学工程学院，项目时间： 至 2016-12-31

纵向项目

  • 1. 大数据及人工智能驱动的原子级分散催化剂开发及其在碱性电解水产氢的应用 ，国家自然科学基金项目，项目时间：2025-01-01 至 2029-12-31
  • 2. 面向丙烯氢甲酰化的高区域选择性分子筛限域单原子催化剂的基础研究 ，其他研究项目，项目时间：2024-04-01 至 2027-03-31
  • 3. 高选择性长链α-烯烃氢甲酰化Rh基原子级分散催化剂及多相催化反应工艺的基础研究 ，国家自然科学基金项目，项目时间：2024-01-01 至 2027-12-31
  • 4. 新型工业化背景下宁东精细化工科学与技术发展战略研究 ，其他研究项目，项目时间：2023-12-01 至 2024-11-30
  • 5. 单原子催化剂的理性设计与精准构筑 ，国家重点研发计划，项目时间：2022-01-01 至 2026-12-31
  • 6. XJZ2022030014 ，主管部门科技项目，项目时间：2021-10-01 至 2024-10-01
  • 7. 丙烷脱氢反应中氧化物负载铂单原子的热稳定性和催化性能调控 ，国家自然科学基金项目，项目时间：2021-01-01 至 2024-12-31
  • 8. BHJG2021027 ，主管部门科技项目，项目时间：2020-11-30 至 2024-11-01
  • 9. 化工行业典型VOCs治理的超重力强化机制与效能研究 ，国家自然科学基金项目，项目时间：2020-01-01 至 2022-12-31
  • 10. 碱性膜燃料电池关键纳米材料的理性设计与筛选 ，科技部重大专项，项目时间：2019-11-01 至 2024-10-31
  • 11. 下一代燃料电池纳米催化材料及器件 ，国家重点研发计划，项目时间：2019-11-01 至 2024-10-31
  • 12. 金属合金催化剂的化工热力学基础 ，国家自然科学基金项目，项目时间：2019-01-01 至 2021-12-31
  • 13. 气固反应中金属合金纳米催化剂介尺度结构的形成机制及调控 ，国家自然科学基金项目，项目时间：2017-01-01 至 2019-12-31
  • 14. 铂基金属合金纳米粒子催化剂协同催化CO氧化的机理研究 ，国家自然科学基金项目，项目时间：2016-01-01 至 2019-12-31
  • 15. 多相反应过程中的表界面结构和相际传递现象研究 ，国家自然科学基金项目，项目时间：2014-01-01 至 2017-12-01
  • 16. 用于富氢气中CO优先氧化的铂基双金属纳米簇催化剂的理论与实验研究 ，省、市、自治区科技项目，项目时间：2013-11-01 至 2014-04-30
  • 17. 双金属纳米簇基燃料电池催化剂的多尺度计算设计及实验设备 ，省、市、自治区科技项目，项目时间：2012-12-01 至 2015-12-31
  • 18. 一氧化碳和氧的表面吸附致金属纳米簇催化剂微结构变化的机理研究 ，国家自然科学基金项目，项目时间：2012-01-01 至 2014-12-31

横向项目

  • 1. 新型橡胶助剂研究与开发 ，企事业单位委托科技项目，项目时间：2024-12-25 至 2026-06-30
  • 2. 原子级分散Pd催化剂的设计制备及催化加氢性能研究 ，企事业单位委托科技项目，项目时间：2024-05-28 至 2026-12-31
  • 3. 丙酮生产MIBK 非含溴新型催化剂开发 ，其他研究项目，项目时间：2024-03-10 至 2034-03-09
  • 4. 粉末状金属催化剂的高通量浸渍法制备技术开发与应用合作技术开发合同 ，企事业单位委托科技项目，项目时间：2024-01-01 至 2025-12-31
  • 5. 聚对苯二甲酸乙二醇酯（PET）催化降解回收单体 ，企事业单位委托科技项目，项目时间：2023-07-01 至 2029-07-01
  • 6. 原子级分散催化剂精准构筑及其生物质催化转化性能研究 ，企事业单位委托科技项目，项目时间：2023-03-15 至 2033-03-14
  • 7. 用于CO2电还原制C2产物的Mxene负载单原子催化剂设计与制备 ，企事业单位委托科技项目，项目时间：2023-03-06 至 2033-03-09
  • 8. 高效二氧化碳电还原制乙烯技术开发 ，企事业单位委托科技项目，项目时间：2022-10-15 至 2025-06-30
  • 9. 质子交换膜电解槽制氢工艺研究 ，企事业单位委托项目，项目时间：2022-10-15 至 2025-06-30
  • 10. 新型耐迁移苯胺防老剂的设计与合成 ，企事业单位委托科技项目，项目时间：2022-09-01 至 2024-08-31
  • 11. Rh原子级分散催化剂精准构筑及丙烯羰基合成丁辛醇性能调控 ，企事业单位委托科技项目，项目时间：2022-08-26 至 2024-08-25
  • 12. CO2加氢制长链α烯烃催化剂研制 ，企事业单位委托科技项目，项目时间：2022-06-01 至 2024-12-31
  • 13. 重整生成油液相选择性加氢催化剂的理论设计 ，企事业单位委托科技项目，项目时间：2021-07-15 至 2022-09-30
  • 14. 异丁烷正构化制备正丁烷催化剂开发 ，企事业单位委托科技项目，项目时间：2021-06-03 至 2031-06-02
  • 15. 直接合成双氧水的钯钨催化剂的设计与制备 ，企事业单位委托科技项目，项目时间：2021-01-01 至 2022-12-31
  • 16. JG202061 ，企事业单位委托项目，项目时间：2020-11-01 至 2020-12-31
  • 17. 乙烯环氧化制环氧乙烷银催化剂动力学研究 ，自选课题，项目时间：2020-08-01 至 2021-12-31
  • 18. 烷基化原料选择加氢除丁二烯催化剂理论设计研究 ，企事业单位委托科技项目，项目时间：2018-03-01 至 2019-03-31
  • 19. 3D打印催化剂载体结构的计算表征及其构效关系研究 ，企事业单位委托科技项目，项目时间：2018-03-01 至 2019-12-30
  • 20. 氢燃料电池用新型高效铂基金属合金催化材料的研究开发 ，企事业单位委托科技项目，项目时间：2016-10-01 至 2018-09-30
  • 21. 费托脱碳尾气VOCs处理技术 ，企事业单位委托科技项目，项目时间：2016-06-06 至 2017-06-06
  • 22. 煤间接液化过程废水的深度处理工艺评估 ，项目时间：2015-12-15 至 2016-01-15
  • 23. HPC业务Wep应用初步探索 ，项目时间：2013-12-04 至 2014-02-01
  • 24. 自热式催化燃烧反应器 ，项目时间：2012-03-03 至 2032-03-02

论文信息

[+][-]代表性论文
  • 1. DOI Zhang, Huimin;Liu, Wenhao;Li, Zhenhao;Qiao, Liang;Chi, Kebin;Guo, Xiaoyan;Cao, Dong;Cheng, Daojian
    Constructing CoP/Ni2P Heterostructure Confined Ru Sub-Nanoclusters for Enhanced Water Splitting in Wide pH Conditions[期刊论文]，Advanced Science，2024-09-18
  • 2. DOI Cao, Dong;Zhang, Zhirong;Cui, Yahui;Zhang, Runhao;Zhang, Lipeng;Zeng, Jie;Cheng, Daojian
    One-Step Approach for Constructing High-Density Single-Atom Catalysts toward Overall Water Splitting at Industrial Current Densities[期刊论文]，Angewandte Chemie-International Edition，2023-02-20
  • 3. DOI Sun, Jindong;Xu, Haoxiang;Ma, Haowen;Zhan, Xuecheng;Zhu, Jiqin;Cheng, Daojian
    Isoprene selective hydrogenation using AgCu-promoted Pd nanoalloys[期刊论文]，FARADAY DISCUSSIONS，2023-01-31
  • 4. DOI Liu, Tianpeng;Liu, Wenhao;Ma, Mengyao;Guo, Linke;Cui, Rong;Cheng, Daojian;Cao, Dong
    Constructing nickel vanadium phosphide nanoarrays with highly active heterointerfaces for water oxidation in alkali media[期刊论文]，ELECTROCHIMICA ACTA，2023-01-20
  • 5. DOI Cao, Dong;Huang, Xiaoyu;Zhang, Huimin;Liu, Wenhao;Cheng, Daojian
    Constructing porous RuCu nanotubes with highly efficient alloy phase for water splitting in different pH conditions[期刊论文]，Chemical Engineering Journal，2023-01-15
  • 6. DOI Wang, Jiayi;Xu, Haoxiang;Che, Chunxia;Zhu, Jiqin;Cheng, Daojian
    Rational Design of PdAg Catalysts for Acetylene Selective Hydrogenation via Structural Descriptor-based Screening Strategy[期刊论文]，ACS Catalysis，2023-01-06
  • 7. DOI Zhang, Huimin;Guo, Xiaoyan;Liu, Wenhao;Wu, Dengfeng;Cao, Dong;Cheng, Daojian
    Regulating surface composition of platinum-copper nanotubes for enhanced hydrogen evolution reaction in all pH values[期刊论文]，Journal of Colloid and Interface Science，2023-01-01
  • 8. DOI Cao, Dong;Shao, Jie;Cui, Yahui;Zhang, Lipeng;Cheng, Daojian
    Interfacial Engineering of Copper–Nickel Selenide Nanodendrites for Enhanced Overall Water Splitting in Alkali Condition[期刊论文]，Small，2023-01-01
  • 9. DOI Wang, Xuning;Xu, Haoxiang;Luo, Yibin;Cheng, Daojian
    High Selective Direct Synthesis of H2O2 over Pd-1@gamma-Al2O3 Single-Atom Catalyst[期刊论文]，CHEMCATCHEM，2022-11-08
  • 10. DOI Deng, Zhuoran;Zhao, Liqiang;Cheng, Daojian
    A high-throughput catalyst synthesis system for Ag-based catalysts[期刊论文]，Review of Scientific Instruments，2022-11-01
  • 11. DOI Xu, Xiaopei;Peng, Zhipeng;Xu, Haoxiang;Cheng, Daojian
    Computational screening of nonmetal dopants to active MoS2 basal-plane for hydrogen evolution reaction via structural descriptor[期刊论文]，Journal of Catalysis，2022-10-31
  • 12. DOI 曹东,许昊翔,Hongliang Li,Chen Feng,Jie Zeng,程道建
    Volcano-type relationship between oxidation states and catalytic activity of single-atom catalysts towards hydrogen evolution[期刊论文]，Nature Communications，2022-10-04
  • 13. DOI Yan, Jingjing;Xu, Haoxiang;Chang, Le;Lin, Aijun;Cheng, Daojian
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single-atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 14. DOI 燕晶晶,许昊翔,常乐,林爱军,程道建
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 15. DOI Cheng, Feipeng;Cheng, Jihao;Nan, Yang;Xie, Yuan;Yang, Tongqian;Cheng, Daojian;Zhu, Jiqin;Xu, Haoxiang
    Enhancing oxidative hydration of ethylene towards ethylene glycol over metal-modified titanosilicate catalysts[期刊论文]，Applied Catalysis A: General，2022-08-05
  • 16. DOI Wen, Qi-Xing;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Design of CuCs-doped Ag-based catalyst for ethylene epoxidation[期刊论文]，Chinese Journal of Chemical Physics，2022-08-01
  • 17. DOI 张眉佳,许昊翔,罗一斌,朱吉钦,程道建
    Enhancing the catalytic performance of PdAu catalysts by W induced strong interaction for the direct synthesis of H2O2[期刊论文]，Catalysis Science & Technology，2022-07-26
  • 18. DOI Deng, Zhuoran;Zhou, Yingcheng;Zhao, Liqiang;Cheng, Daojian
    Structures and structural evolution of M-N (M = Pt, Ag, Au, N=2-20) from combined revised particle swarm optimization and density function theory[期刊论文]，MOLECULAR SIMULATION，2022-07-03
  • 19. DOI Zhang, Huimin;Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Carbon-based material-supported single-atom catalysts for energy conversion[期刊论文]，ISCIENCE，2022-06-17
  • 20. DOI 陈志强;车春霞;吴登峰;温翯;韩伟;张峰;许昊翔;程道建
    乙炔选择性加氢催化剂研究进展[期刊论文]，化工进展，2022-03-17
  • 21. DOI Liu, Ning;Cao, Dong;Liu, Wenhao;Zhang, Huimin;Zhu, Yinhai;Chang, Le;Wu, Dengfeng;Cheng, Daojian
    Constructing La-doped ultrathin Co-based nanostructured electrocatalysts for high-performance water oxidation process[期刊论文]，International Journal of Hydrogen Energy，2022-01-01
  • 22. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Branch-leaf-shaped CuNi@NiFeCu nanodendrites as highly efficient electrocatalysts for overall water splitting[期刊论文]，Applied Catalysis B-Environmental，2021-12-05
  • 23. DOI Zhang, Meijia;Luo, Yibin;Wu, Dengfeng;Li, Qian;Xu, Haoxiang;Cheng, Daojian
    Promoter role of tungsten in W-Pd/Al2O3 catalyst for direct synthesis of H2O2: Modification of Pd/PdO ratio[期刊论文]，APPLIED CATALYSIS A-GENERAL，2021-11-25
  • 24. DOI 孙晋冬;展学成;吴登峰;谢元;马好文;许昊翔;程道建
    碳四炔烃选择性加氢催化剂研究进展[期刊论文]，石油学报(石油加工)，2021-10-15
  • 25. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Construction of Dual-Site Atomically Dispersed Electrocatalysts with Ru-C-5 Single Atoms and Ru-O-4 Nanoclusters for Accelerated Alkali Hydrogen Evolution[期刊论文]，Small，2021-08-01
  • 26. DOI Cao, Dong;Wang, Jiayi;Zhang, Huimin;Xu, Haoxiang;Cheng, Daojian
    Growth of IrCu nanoislands with rich IrCu/Ir interfaces enables highly efficient overall water splitting in non-acidic electrolytes[期刊论文]，Chemical Engineering Journal，2021-07-15
  • 27. DOI Zhu, Yinhai;Cao, Dong;Liu, Ning;Cheng, Daojian
    One-step synthesis of atomic Ru doped ultra-thin Co(OH)(2) nanosheets for oxygen evolution reaction in different pH values[期刊论文]，International Journal of Hydrogen Energy，2021-06-28
  • 28. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Metal Dopants in Enhancing the Selectivity of Ag-Catalyzed Ethylene Epoxidation: Optimizing Oxophilicity of Reaction Site via Cocatalytic Mechanism[期刊论文]，ACS Catalysis，2021-03-19
  • 29. DOI 吴建国;吴登峰;程道建
    丙烷脱氢制丙烯用单原子催化剂研究进展[期刊论文]，化工进展，2021-03-16
  • 30. DOI Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Review on Synthesis and Catalytic Coupling Mechanism of Highly Active Electrocatalysts for Water Splitting[期刊论文]，Energy Technology，2021-02-01
  • 31. DOI Ma, Haowen;Xu, Xiaopei;Xu, Haoxiang;Feng, Huixia;Xie, Yuan;Cheng, Daojian
    Understanding composition-dependent catalytic performance of PdAg for the hydrogenation of 1,3-butadiene to 1-butene[期刊论文]，CATALYSIS COMMUNICATIONS，2021-01-15
  • 32. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文]，Advances in Physics-X，2021-01-01
  • 33. DOI Huang, Xingkai;Xu, Haoxiang;Cao, Dong;Cheng, Daojian
    Interface construction of P-Substituted MoS2 as efficient and robust electrocatalyst for alkaline hydrogen evolution reaction[期刊论文]，Nano Energy，2020-12-01
  • 34. DOI Yang, Liu,许昊翔,Liu, Huibing,曾晓飞,程道建,黄燕,Zheng, Lirong,Cao, Rui,曹达鹏
    Oxygen-Reconstituted Active Species of Single-Atom Cu Catalysts for Oxygen Reduction Reaction[期刊论文]，Research，2020-10-05
  • 35. DOI Xu, Xiaopei,许昊翔,程道建
    Identification of the Anti-triangular Etched MoS2 with Comparative Activity with Commercial Pt for Hydrogen Evolution Reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-10-04
  • 36. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Growth of Highly Active Amorphous RuCu Nanosheets on Cu Nanotubes for the Hydrogen Evolution Reaction in Wide pH Values[期刊论文]，Small，2020-09-01
  • 37. DOI 许昊翔,程道建
    First-principles-aided Thermodynamic Modeling of Transition-metal Heterogeneous Catalysts: A review.[期刊论文]，Green Energy & Environment，2020-07-14
  • 38. DOI Xu, Haoxiang;Cheng, Daojian
    First-principles-aided thermodynamic modeling of transition-metal heterogeneous catalysts: A review[期刊论文]，GREEN ENERGY & ENVIRONMENT，2020-07-01
  • 39. DOI Che, Chunxia;Xu, Haoxiang;Wen, He;Gou, Galian;Cheng, Daojian
    Theoretical Study on the Structural, Thermal and Phase Stability of Pt-Cu Alloy Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2020-05-01
  • 40. DOI Zhang, Wei;Zhu, Jiqin;Cheng, Daojian;Zeng, Xiao Cheng
    PtCoNi Alloy Nanoclusters for Synergistic Catalytic Oxygen Reduction Reaction[期刊论文]，ACS APPLIED NANO MATERIALS，2020-03-01
  • 41. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Construction of Defect-Rich RhCu Nanotubes with Highly Active Rh3Cu1 Alloy Phase for Overall Water Splitting in All pH Values[期刊论文]，ADVANCED ENERGY MATERIALS，2020-03-01
  • 42. DOI Wu, Dengfeng;Zhang, Wei;Lin, Aijun;Cheng, Daojian
    Low Pt-Content Ternary PtNiCu Nanoparticles with Hollow Interiors and Accessible Surfaces as Enhanced Multifunctional Electrocatalysts[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2020-02-26
  • 43. DOI Wu, Dengfeng;Yang, Yang;Dai, Changqing;Cheng, Daojian
    Enhanced oxygen reduction activity of PtCu nanoparticles by morphology tuning and transition-metal doping[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-02-07
  • 44. DOI Huang, Xingkai;Xu, Xiaopei;Luan, Xiaoxu;Cheng, Daojian
    CoP nanowires coupled with CoMoP nanosheets as a highly efficient cooperative catalyst for hydrogen evolution reaction[期刊论文]，NANO ENERGY，2020-02-01
  • 45. DOI Zhou, Yingcheng;Zhao, Zheng;Cheng, Daojian
    Cluster structure prediction via revised particle-swarm optimization algorithm[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2020-02-01
  • 46. DOI Li, Lin-Xin;Xie, Zhi-Hui;Fernandez, Carlos;Wu, Liang;Cheng, Daojian;Jiang, Xiao-Hui;Zhong, Chuan-Jian
    Development of a thiophene derivative modified LDH coating for Mg alloy corrosion protection[期刊论文]，ELECTROCHIMICA ACTA，2020-01-10
  • 47. DOI Zhang, Junmeng;Xu, Xiaopei;Yang, Liu;Cheng, Daojian;Cao, Dapeng
    Single-Atom Ru Doping Induced Phase Transition of MoS2 and S Vacancy for Hydrogen Evolution Reaction[期刊论文]，SMALL METHODS，2019-12-11
  • 48. DOI Zhao, Zheng,许昊翔,Feng, Zongyu,Zhang, Yongqi,Cui, Meisheng,曹达鹏,程道建
    Design of High-Performance Co-Based Alloy Nanocatalysts for the Oxygen Reduction Reaction[期刊论文]，Chemistry - A European Journal，2019-12-03
  • 49. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Chlorine in Selectivity Enhancement of Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-11-27
  • 50. DOI Xu, Xiaopei;Xu, Haoxiang;Cheng, Daojian
    Design of high-performance MoS2 edge supported single-metal atom bifunctional catalysts for overall water splitting via a simple equation[期刊论文]，NANOSCALE，2019-11-14
  • 51. DOI Wu, Dengfeng;Cheng, Daojian
    Structure-controlled synthesis of one-dimensional PdCu nanoscatalysts via a seed-mediated approach for oxygen reduction reaction[期刊论文]，APPLIED SURFACE SCIENCE，2019-11-01
  • 52. DOI Huang, Xiaoyu;Yang, Yang;Cheng, Daojian
    Hydrogen generation from formic acid decomposition on Pd-Cu nanoalloys[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-09-13
  • 53. DOI Zhang, Wei;Deibert, David L.;Cheng, Daojian;Zeng, Xiao Cheng
    Magnetism in bimetallic PtxNiN-x clusters via cross-atomic coupling[期刊论文]，JOURNAL OF MATERIALS CHEMISTRY C，2019-08-14
  • 54. DOI Ma, Haowen;Yang, Yang;Feng, Huixia;Cheng, Daojian
    DFT Study of Pyrolysis Gasoline Hydrogenation on Pd(100), Pd(110) and Pd(111) Surfaces[期刊论文]，CATALYSIS LETTERS，2019-08-01
  • 55. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Fortunelli, Alessandro;Cheng, Daojian
    Selectivity-Driven Design of the Ag-Cu Alloys for the Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-07-24
  • 56. DOI Cao, Dong;Cheng, Daojian
    One-pot synthesis of copper-nickel sulfide nanowires for overall water splitting in alkaline media[期刊论文]，CHEMICAL COMMUNICATIONS，2019-07-18
  • 57. DOI Huang, Xingkai;Xu, Xiaopei;Li, Chao;Wu, Dengfeng;Cheng, Daojian;Cao, Dapeng
    Vertical CoP Nanoarray Wrapped by N,P-Doped Carbon for Hydrogen Evolution Reaction in Both Acidic and Alkaline Conditions[期刊论文]，ADVANCED ENERGY MATERIALS，2019-06-01
  • 58. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Cheng, Daojian
    The synergistic effect between crystal planes and promoters on Ag-catalyzed ethylene epoxidation[期刊论文]，APPLIED SURFACE SCIENCE，2019-05-15
  • 59. DOI Yang, Liu;Xu, Haoxiang;Liu, Huibing;Cheng, Daojian;Cao, Dapeng
    Active Site Identification and Evaluation Criteria of In Situ Grown CoTe and NiTe Nanoarrays for Hydrogen Evolution and Oxygen Evolution Reactions[期刊论文]，SMALL METHODS，2019-05-10
  • 60. DOI Yang, Chenxi;Wang, Guoqing;Liang, Aimin;Yue, Yi;Peng, Hui;Cheng, Daojian
    Understanding the role of Au in the selective hydrogenation of acetylene on trimetallic PdAgAu catalytic surface[期刊论文]，CATALYSIS COMMUNICATIONS，2019-05-05
  • 61. DOI Li, Pengcheng;Wu, Dengfeng;Dai, Changqing;Huang, Xingkai;Li, Chao;Yin, Zhen;Zhou, Song;Lv, Zhengang;Cheng, Daojian;Zhu, Jiqin;Xu, Jian;Liu, Xi
    Controlled Synthesis of Copper-Doped Molybdenum Carbide Catalyst with Enhanced Activity and Stability for Hydrogen Evolution Reaction[期刊论文]，CATALYSIS LETTERS，2019-05-01
  • 62. DOI Elouarzaki Kamal,Wang Yian,Kannan Vishvak,许昊翔,程道建,Lee Jong-Min,Fisher Adrian C.
    Hydrogenase-Like Electrocatalytic Activation and Inactivation Mechanism by Three-Dimensional Binderless Molecular Catalyst[期刊论文]，ACS Applied Energy Materials，2019-04-09
  • 63. DOI Xu, Haoxiang;Cheng, Daojian
    Rational design of transition metal nanocatalyst by structure descriptor[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2019-03-31
  • 64. DOI Yang, Mengjie;Wu, Dengfeng;Cheng, Daojian
    Biomass-derived porous carbon supported Co-CoO yolk-shell nanoparticles as enhanced multifunctional electrocatalysts[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-03-08
  • 65. DOI Zhao, Zheng;Kong, Kewei;Wang, Shixian;Zhou, Yingcheng;Cheng, Daojian;Wang, Wenchuan;Zeng, Xiao Cheng;Li, Hui
    Understanding Hygroscopic Nucleation of Sulfate Aerosols: Combination of Molecular Dynamics Simulation with Classical Nucleation Theory[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY LETTERS，2019-03-07
  • 66. DOI Lv, Yanlong,朱琳,许昊翔,Yang, Liu,刘志平,程道建,Cao, Xiaohua,Yun Jimmy,曹达鹏
    Core/shell Template-derived Co, N-doped Carbon Bifunctional Electrocatalysts for Rechargeable Zn-air Battery[期刊论文]，Engineered Science，2019-02-28
  • 67. DOI Zhao, Zheng;Xu, Haoxiang;Gao, Yi;Cheng, Daojian
    Universal description of heating-induced reshaping preference of core-shell bimetallic nanoparticles[期刊论文]，NANOSCALE，2019-01-21
  • 68. DOI Yang, Yang,Zhao, Zheng,程道建,朱吉钦
    Effect of Size and Composition on the Structural Stability of Pt–Ni Nanoalloys[期刊论文]，Journal of Cluster Science，2019-01-14
  • 69. DOI Nan, Yang;Wang, Yinuo;Cao, Dong;Yang, Yang;Cheng, Daojian
    Adsorption and dissociation of borohydride on different Ir-Ni alloy surfaces[期刊论文]，Appl Surf Sci，2019-01-01
  • 70. DOI Yang, Yang,许昊翔,曹达鹏,曾晓成,程道建
    Hydrogen Production via Efficient Formic Acid Decomposition: Engineering the Surface Structure of Pd-Based Alloy Catalysts by Design[期刊论文]，ACS Catalysis，2018-12-07
  • 71. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Zhu, Jiqin;Cheng, Daojian
    Facet-dependent diffusion of atomic oxygen on Ag surfaces[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2018-12-01
  • 72. DOI Chang, Le;Cheng, Daojian;Sementa, Luca;Fortunelli, Alessandro
    Hydrogen evolution reaction (HER) on Au@Ag ultrananoclusters as electro-catalysts[期刊论文]，NANOSCALE，2018-10-07
  • 73. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi;Zeng, Xiao Cheng
    Assessment of Catalytic Activities of Gold Nanoclusters with Simple Structure Descriptors[期刊论文]，ACS CATALYSIS，2018-10-01
  • 74. DOI Yang, Yang;Dai, Changqing;Wu, Dengfeng;Liu, Zhiping;Cheng, Daojian
    The Size Effect of PdCu Bimetallic Nanoparticles on Oxygen Reduction Reaction Activity[期刊论文]，CHEMELECTROCHEM，2018-09-12
  • 75. DOI Lian, Xiaojun;Niu, Mang;Huang, Yan;Cheng, Daojian
    MoS2-CdS heterojunction with enhanced photocatalytic activity: A first principles study[期刊论文]，JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS，2018-09-01
  • 76. DOI Huang, Yichao;Hu, Jun;Xu, Haoxiang;Bian, Wei;Ge, Jingxuan;Zang, Dejin;Cheng, Daojian;Lv, Yaokang;Zhang, Cheng;Gu, Jing;Wei, Yongge
    Fine Tuning Electronic Structure of Catalysts through Atomic Engineering for Enhanced Hydrogen Evolution[期刊论文]，ADVANCED ENERGY MATERIALS，2018-08-27
  • 77. DOI Miao, Xue-Pei;Cheng, Dao-Jian;Dai, Ya-Dong;Meng, Yan;Li, Xiao-Yu
    Origin of Modulus Improvement for Epoxide-terminated Hyperbranched Poly(ether sulphone)/DGEBA/TETA Systems[期刊论文]，CHINESE JOURNAL OF POLYMER SCIENCE，2018-08-01
  • 78. DOI Chang, Le;Baseggio, Oscar;Sernenta, Luca;Cheng, Daojian;Fronzoni, Giovanna;Toffoli, Daniele;Apra, Edoardo;Stener, Mauro;Fortunelli, Alessandro
    Individual Component Map of Rotatory Strength and Rotatory Strength Density Plots As Analysis Tools of Circular Dichroism Spectra of Complex Systems[期刊论文]，JOURNAL OF CHEMICAL THEORY AND COMPUTATION，2018-07-01
  • 79. DOI Elouarzaki, Kamal;Cheng, Daojian;Fisher, Adrian C.;Lee, Jong-Min
    Coupling orientation and mediation strategies for efficient electron transfer in hybrid biofuel cells[期刊论文]，NATURE ENERGY，2018-07-01
  • 80. DOI Wang, Zegao;Li, Qiang;Xu, Haoxiang;Dahl-Petersen, Christian;Yang, Qian;Cheng, Daojian;Cao, Dapeng;Besenbacher, Flemming;Lauritsen, Jeppe V.;Helveg, Stig;Dong, Mingdong
    Controllable etching of MoS2 basal planes for enhanced hydrogen evolution through the formation of active edge sites[期刊论文]，NANO ENERGY，2018-07-01
  • 81. DOI Yang, Liu;Cheng, Daojian;Zeng, Xiaofei;Wan, Xin;Shui, Jianglan;Xiang, Zhonghua;Cao, Dapeng
    Unveiling the high-activity origin of single-atom iron catalysts for oxygen reduction reaction[期刊论文]，PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA，2018-06-26
  • 82. DOI 杨洋,Yu, Haiyan,Cai, Yushun,Ferrando, Riccardo,程道建
    Origin of enhanced stability and oxygen adsorption capacity of mediumsized Pt–Ni nanoclusters[期刊论文]，Journal of Physics: Condensed Matter，2018-06-22
  • 83. DOI Yu, Haiyan,Yang, Liu,程道建,曹达鹏
    Zeolitic-imidazolate Framework (ZIF)@ZnCo-ZIF Core-shell Template Derived Co, N-doped Carbon Catalysts for Oxygen Reduction Reaction[期刊论文]，Engineered Science，2018-06-02
  • 84. DOI 吴登峰,Zhang, Xin,朱吉钦,程道建
    Concerted Catalysis on Tanghulu-like Cu@Zeolitic Imidazolate Framework-8 (ZIF-8) Nanowires with Tuning Catalytic Performances for 4-nitrophenol Reduction[期刊论文]，Engineered Science，2018-05-21
  • 85. DOI Huang, Yan;Wu, Dengfeng;Cao, Dapeng;Cheng, Daojian
    Facile preparation of biomass-derived bifunctional electrocatalysts for oxygen reduction and evolution reactions[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2018-05-03
  • 86. DOI Xu, Haoxiang;Cheng, Daojian;Cao, Dapeng;Zeng, Xiao Cheng
    A universal principle for a rational design of single-atom electrocatalysts[期刊论文]，NATURE CATALYSIS，2018-05-01
  • 87. DOI Li, Zhenhao;Zhu, Lin;Chen, Jian-Feng;Cheng, Daojian
    Enhanced Ethylene Oxide Selectivity by Cu and Re Dual-Promoted Ag Catalysts[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2018-03-28
  • 88. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian
    Enhanced photochemical performance of hexagonal WO3 by metal-assisted S-O coupling for solar-driven water splitting[期刊论文]，SCIENCE CHINA-MATERIALS，2018-01-01
  • 89. DOI Xu, Haoxiang;Xu, Cong-Qiao;Cheng, Daojian;Li, Jun
    Identification of activity trends for CO oxidation on supported transition-metal single-atom catalysts[期刊论文]，CATALYSIS SCIENCE & TECHNOLOGY，2017-12-21
  • 90. DOI Ren, Dongmei;Cheng, Gang;Li, Jianwei;Li, Jinbing;Dai, Wujun;Sun, XinXin;Cheng, Daojian
    Effect of Rhenium Loading Sequence on Selectivity of Ag-Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-12-01
  • 91. DOI Huang, Xingkai;Wu, Dengfeng;Cheng, Daojian
    Porous Co2P nanowires as high efficient bifunctional catalysts for 4-nitrophenol reduction and sodium borohydride hydrolysis[期刊论文]，JOURNAL OF COLLOID AND INTERFACE SCIENCE，2017-12-01
  • 92. DOI Ren, Dongmei;Xu, Haoxiang;Li, Jianwei;Li, Jinhing;Cheng, Daojian
    Origin of enhanced ethylene oxide selectivity by Cs-promoted silver catalyst[期刊论文]，MOLECULAR CATALYSIS，2017-11-01
  • 93. DOI Wei, Yongsheng;Huang, Xingkai;Wang, Junyan;Yu, Haiyan;Zhao, Xinsheng;Cheng, Daojian
    Synthesis of bifunctional non-noble monolithic catalyst Co-W-P/carbon cloth for sodium borohydride hydrolysis and reduction of 4-nitrophenol[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2017-10-12
  • 94. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 95. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 96. DOI Yan, Bailu;Zhao, Zheng;Zhou, Yingcheng;Yuan, Wenyan;Li, Jian;Wu, Jun;Cheng, Daojian
    A particle swarm optimization algorithm with random learning mechanism and Levy flight for optimization of atomic clusters[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2017-10-01
  • 97. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 98. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 99. DOI Yang, Yang;Dai, Changqing;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    A full understanding of oxygen reduction reaction mechanism on Au(111) surface[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2017-09-13
  • 100. DOI Shan, Aixian;Chen, Chinping;Zhang, Wei;Cheng, Daojian;Shen, Xi;Yu, Richeng;Wang, Rongming
    Giant enhancement and anomalous temperature dependence of magnetism in monodispersed NiPt2 nanoparticles[期刊论文]，NANO RESEARCH，2017-09-01
  • 101. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 102. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 103. DOI Zhang, Xing;Wu, Dengfeng;Cheng, Daojian
    Component-dependent electrocatalytic activity of PdCu bimetallic nanoparticles for hydrogen evolution reaction[期刊论文]，ELECTROCHIMICA ACTA，2017-08-20
  • 104. DOI Zhao, Zheng;Wang, Fang-Hui;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Phase stability and segregation behavior of nickel-based nanoalloys based on theory and simulation[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2017-06-25
  • 105. DOI Wu, Dengfeng;Zhang, Wei;Cheng, Daojian
    Facile Synthesis of Cu/NiCu Electrocatalysts Integrating Alloy, Core Shell, and One-Dimensional Structures for Efficient Methanol Oxidation Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2017-06-14
  • 106. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 107. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 108. DOI Zhang, Wei;Shan, Shiyao;Luo, Jin;Fisher, Adrian;Chen, Jian-Feng;Zhong, Chuan-Jian;Zhu, Jiqin;Chen, Daojian
    Origin of Enhanced Activities for CO Oxidation and O-2 Reaction over Composition-Optimized Pd50Cu50 Nanoalloy Catalysts[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2017-05-25
  • 109. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin;Cheng, Daojian
    Mechanistic insight into the facet-dependent selectivity of ethylene epoxidation on Ag nanocatalysts[期刊论文]，APPLIED CATALYSIS A: GENERAL，2017-05-25
  • 110. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin
    Ni (111)-supported graphene as a potential catalyst for high-efficient CO oxidation[期刊论文]，CARBON，2017-05-01
  • 111. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi
    Design of High-Performance Pd-Based Alloy Nanocatalysts for Direct Synthesis of H2O2[期刊论文]，ACS CATALYSIS，2017-03-01
  • 112. DOI Yu, Haiyan;Cao, Dapeng;Fisher, Adrian;Johnston, Roy L.;Cheng, Daojian
    Size effect on the adsorption and dissociation of CO2 on Co nanoclusters[期刊论文]，APPLIED SURFACE SCIENCE，2017-02-28
  • 113. DOI Lian, Xiaojun;Zhao, Zheng;Cheng, Daojian
    Recent progress on triphenylamine materials: synthesis, properties, and applications[期刊论文]，MOLECULAR CRYSTALS AND LIQUID CRYSTALS，2017-01-01
  • 114. DOI Wu, Dengfeng;Xu, Haoxiang;Cao, Dapeng;Fisher, Adrian;Gao, Yi;Cheng, Daojian
    PdCu alloy nanoparticle-decorated copper nanotubes as enhanced electrocatalysts: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-12-09
  • 115. DOI Dai, Changqing;Yang, Yang;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Interaction of CO2 with metal cluster-functionalized ionic liquids[期刊论文]，JOURNAL OF CO2 UTILIZATION，2016-12-01
  • 116. DOI Wei, Chengcheng;Zhao, Zheng;Fisher, Adrian;Zhu, Jiqin;Cheng, Daojian
    Theoretical Study on the Structures and Thermal Properties of Ag-Pt-Ni Trimetallic Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-11-01
  • 117. DOI Cheng, Daojian;Wu, Dengfeng;Xu, Haoxiang;Fisher, Adrian
    Composition-controlled Synthesis of PtCuNPs Shells on Copper Nanowires as Electrocatalysts[期刊论文]，CHEMISTRYSELECT，2016-09-16
  • 118. DOI Yu, Haiyan;Fisher, Adrian;Cheng, Daojian;Cao, Dapeng
    Cu,N-codoped Hierarchical Porous Carbons as Electrocatalysts for Oxygen Reduction Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2016-08-24
  • 119. DOI Yang, Yang;Dai, Changqing;Shen, Yanchun;Fisher, Adrian;Cheng, Daojian
    Design of binary and ternary platinum shelled electrocatalysts with inexpensive metals for the oxygen reduction reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2016-08-10
  • 120. DOI Liu, Xinyue;Dai, Changqing;Wu, Dengfeng;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Facile Synthesis of PdAgCo Trimetallic Nanoparticles for Formic Acid Electrochemical Oxidation[期刊论文]，CHEMISTRY LETTERS，2016-07-05
  • 121. DOI 程道建
    双金属纳米电催化:理论和实验研究[会议论文]，中国化学会第30届学术年会摘要集-第二十九分会：电化学材料，2016-07-01
  • 122. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    A density functional theory study of sulfur adsorption on Ag-Au nanoalloys[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2016-06-01
  • 123. DOI 程道建
    双金属纳米催化:理论和实验研究[会议论文]，第七届全国物理无机化学学术会议论文集，2016-05-06
  • 124. DOI Zhao, Zheng;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Magnetic Properties of Pt-Based Nanoalloys: A Critical Review[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-05-01
  • 125. DOI Zhao, Zheng;Fisher, Adrian;Cheng, Daojian
    Phase diagram and segregation of Ag-Co nanoalloys: insights from theory and simulation[期刊论文]，NANOTECHNOLOGY，2016-03-18
  • 126. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Huan, Haifeng;Cao, Dapeng
    Enhanced near-infrared shielding ability of (Li, K)-codoped WO3 for smart windows: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-02-09
  • 127. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Highly sensitive and selective colorimetric detection of sulphide using Ag-Au nanoalloys: a DFT study[期刊论文]，RSC ADVANCES，2016-01-01
  • 128. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文]，MOLECULAR SIMULATION，2016-01-01
  • 129. DOI Chang, Le;Liu, Zhiping;Cheng, Daojian
    Optical properties of Ag-Au nanoclusters for sulphide sensing from TDDFT calculations[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2015-12-25
  • 130. DOI Zhang, Wei;Cui, Rong;Wu, Hao;Zhu, Jiqin;Cheng, Daojian
    CO oxidation mechanism on a MgO(100) supported PtxAu3-x clusters[期刊论文]，APPLIED SURFACE SCIENCE，2015-11-30
  • 131. DOI Zhang, Wei;Sumer, Aslihan;Jellinek, Julius;Cheng, Daojian
    Morphology Tailoring of Pt Nanocatalysts for the Oxygen Reduction Reaction: The Paradigm of Pt-13[期刊论文]，CHEMNANOMAT，2015-11-01
  • 132. DOI Wu, Dengfeng;Cheng, Daojian
    Core/shell AgNi/PtAgNi nanoparticles as methanol-tolerant oxygen reduction electrocatalysts[期刊论文]，ELECTROCHIMICA ACTA，2015-10-20
  • 133. DOI wang,qian,fang,yu,孟洪,毋伟,初广文,邹海魁,程道建,陈建峰
    Enhanced simulated sunlight induced photocatalytic activity by pomegranate-like S doped SnO2@TiO2 spheres[期刊论文]，Colloids and Surfaces A: Physicochemical and Engineering Aspects，2015-10-05
  • 134. DOI Niu, Mang;Tan, Huaqiao;Cheng, Daojian;Sun, Zaicheng;Cao, Dapeng
    Bandgap engineering of Magnei phase TinO2n-1: Electron-hole self-compensation[期刊论文]，JOURNAL OF CHEMICAL PHYSICS，2015-08-07
  • 135. DOI Wu, Dengfeng;Dai, Changqing;Li, Shaojie;Cheng, Daojian
    Shape-controlled Synthesis of PdCu Nanocrystals for Formic Acid Oxidation[期刊论文]，CHEMISTRY LETTERS，2015-08-05
  • 136. DOI Niu, Mang;Cui, Rong;Wu, Hao;Cheng, Daojian;Cao, Dapeng
    Enhancement Mechanism of the Conversion Effficiency of Dye-Sensitized Solar Sells Based on Nitrogen-, Fluorine-, and Iodine-Doped TiO2 Photoanodes[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-06-18
  • 137. DOI Yang, Yang;Zhao, Zheng;Cui, Rong;Wu, Hao;Cheng, Daojian
    Structures, Thermal Stability, and Chemical Activity of Crown-Jewel-Structured Pd-Pt Nanoalloys[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-05-21
  • 138. DOI Wang, Jian;Yuan, Wenyan;Cheng, Daojian
    Hybrid genetic-particle swarm algorithm: An efficient method for fast optimization of atomic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2015-05-01
  • 139. DOI Xu, Haoxiang;Cheng, Daojian
    Effect of the Passivating Ligands on the Geometric and Electronic Properties of Au-Pd Nanoalloys[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2015-05-01
  • 140. DOI Chen, Bing;Cheng, Daojian;Zhu, Jiqin
    Synthesis of PtCu nanowires in nonaqueous solvent with enhanced activity and stability for oxygen reduction reaction[期刊论文]，JOURNAL OF POWER SOURCES，2014-12-01
  • 141. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Cao, Dapeng
    Design of the Alkali-Metal-Doped WO3 as a Near-Infrared Shielding Material for Smart Window[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2014-11-19
  • 142. DOI Li, Shaojie;Cheng, Daojian;Qiu, Xiangguo;Cao, Dapeng
    Synthesis of Cu@Pd core-shell nanowires with enhanced activity and stability for formic acid oxidation[期刊论文]，ELECTROCHIMICA ACTA，2014-10-10
  • 143. DOI Chang, Le;Xu, Haoxiang;Cheng, Daojian
    Role of ligand type on the geometric and electronic properties of Ag-Au bimetallic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2014-10-01
  • 144. DOI Zhao, Zheng;Li, Mingjiang;Cheng, Daojian;Zhu, Jiqin
    Understanding the structural properties and thermal stabilities of Au-Pd-Pt trimetallic clustersle[期刊论文]，CHEMICAL PHYSICS，2014-09-30
  • 145. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Fluorite TiO2(111) Surface Phase for Enhanced Visible-Light Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-09-04
  • 146. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    SiH/TiO2 and GeH/TiO2 Heterojunctions: Promising TiO2-based Photocatalysts under Visible Light[期刊论文]，SCIENTIFIC REPORTS，2014-05-02
  • 147. DOI Cheng, Daojian;Xu, Haoxiang;Fortunelli, Alessandro
    Tuning the catalytic activity of Au-Pd nanoalloys in CO oxidation via composition[期刊论文]，JOURNAL OF CATALYSIS，2014-05-01
  • 148. DOI Fang, Yu;Cheng, Daojian;Wu, Wei
    Understanding electronic and optical properties of N-Sn codoped anatase TiO2[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-04-01
  • 149. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding the Mechanism of Photocatalysis Enhancements in the Graphene-like Semiconductor Sheet/TiO2 Composites[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-03-20
  • 150. DOI Cheng, Daojian;Zhang, Minming;Chen, Jianfeng;Yang, Chenxi;Zeng, Xiaofei;Cao, Dapeng
    Computer Screening of Dopants for the Development of New SnO2-Based Transparent Conducting Oxides[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-30
  • 151. DOI Yang, Yang;Cheng, Daojian
    Role of Composition and Geometric Relaxation in CO2 Binding to Cu-Ni Bimetallic Clusters[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-09
  • 152. DOI Zhang, Wei;Cheng, Daojian;Zhu, Jiqin
    Theoretical study of CO catalytic oxidation on free and defective graphene-supported Au-Pd bimetallic clusters[期刊论文]，RSC ADVANCES，2014-01-01
  • 153. DOI Cheng, Daojian;Qiu, Xiangguo;Yu, Haiyan
    Enhancing oxygen reduction reaction activity of Pt-shelled catalysts via subsurface alloying[期刊论文]，PHYSICAL CHEMISTRY CHEMICAL PHYSICS，2014-01-01
  • 154. DOI Tan, Huaqiao;Zhao, Zhao;Niu, Mang;Mao, Chengyu;Cao, Dapeng;Cheng, Daojian;Feng, Pingyun;Sun, Zaicheng
    A facile and versatile method for preparation of colored TiO2 with enhanced solar-driven photocatalytic activity[期刊论文]，NANOSCALE，2014-01-01
  • 155. DOI Li, Mingjiang;Li, Shaojie;Cheng, Daojian
    Influence of adsorbates on the segregation properties of Au-Pd bimetallic clusters[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-01-01
  • 156. DOI Li, Mingjiang;Cheng, Daojian
    Molecular Dynamics Simulation of the Melting Behavior of Crown-Jewel Structured Au-Pd Nanoalloys[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-09-12
  • 157. DOI Cheng, Daojian;Yuan, Shuai;Ferrando, Riccardo
    Structure, chemical ordering and thermal stability of Pt-Ni alloy nanoclusters[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2013-09-04
  • 158. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding Photoelectrochennical Properties of B-N Codoped Anatase TiO2 for Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-08-08
  • 159. DOI Cheng, Daojian;Negreiros, Fabio R.;Apra, Edoardo;Fortunelli, Alessandro
    Computational Approaches to the Chemical Conversion of Carbon Dioxide[期刊论文]，CHEMSUSCHEM，2013-06-01
  • 160. DOI Fang, Yu;Cheng, Daojian;Niu, Mang;Yi, Yongjun;Wu, Wei
    Tailoring the electronic and optical properties of rutile TiO2 by (Nb + Sb, C) codoping from DFT plus U calculations[期刊论文]，CHEMICAL PHYSICS LETTERS，2013-04-19
  • 161. DOI Cheng, Daojian;Cao, Dapeng;Wang, Wenchuan
    Hydrogen storage in porous materials and nanoalloys as catalysts for fuel cell application by using multiscale simulation and experimental methods[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2013-04-07
  • 162. DOI Cheng, Daojian;Jiang, Kun
    Structural stability and kinetics of small carbon clusters on a bimetallic Cu/Ni(111) surface: A first-principles study[期刊论文]，SURFACE SCIENCE，2013-03-01
  • 163. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Enhanced photoelectrochemical performance of anatase TiO2 by metal-assisted S-O coupling for water splitting[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2013-02-06
[+][-] 2030年
  • 1. DOI Zhang, Huimin;Liu, Wenhao;Li, Zhenhao;Qiao, Liang;Chi, Kebin;Guo, Xiaoyan;Cao, Dong;Cheng, Daojian
    Constructing CoP/Ni2P Heterostructure Confined Ru Sub-Nanoclusters for Enhanced Water Splitting in Wide pH Conditions[期刊论文]，Advanced Science，2024-09-18
  • 2. DOI Cao, Dong;Zhang, Zhirong;Cui, Yahui;Zhang, Runhao;Zhang, Lipeng;Zeng, Jie;Cheng, Daojian
    One-Step Approach for Constructing High-Density Single-Atom Catalysts toward Overall Water Splitting at Industrial Current Densities[期刊论文]，Angewandte Chemie-International Edition，2023-02-20
  • 3. DOI Sun, Jindong;Xu, Haoxiang;Ma, Haowen;Zhan, Xuecheng;Zhu, Jiqin;Cheng, Daojian
    Isoprene selective hydrogenation using AgCu-promoted Pd nanoalloys[期刊论文]，FARADAY DISCUSSIONS，2023-01-31
  • 4. DOI Liu, Tianpeng;Liu, Wenhao;Ma, Mengyao;Guo, Linke;Cui, Rong;Cheng, Daojian;Cao, Dong
    Constructing nickel vanadium phosphide nanoarrays with highly active heterointerfaces for water oxidation in alkali media[期刊论文]，ELECTROCHIMICA ACTA，2023-01-20
  • 5. DOI Cao, Dong;Huang, Xiaoyu;Zhang, Huimin;Liu, Wenhao;Cheng, Daojian
    Constructing porous RuCu nanotubes with highly efficient alloy phase for water splitting in different pH conditions[期刊论文]，Chemical Engineering Journal，2023-01-15
  • 6. DOI Wang, Jiayi;Xu, Haoxiang;Che, Chunxia;Zhu, Jiqin;Cheng, Daojian
    Rational Design of PdAg Catalysts for Acetylene Selective Hydrogenation via Structural Descriptor-based Screening Strategy[期刊论文]，ACS Catalysis，2023-01-06
  • 7. DOI Zhang, Huimin;Guo, Xiaoyan;Liu, Wenhao;Wu, Dengfeng;Cao, Dong;Cheng, Daojian
    Regulating surface composition of platinum-copper nanotubes for enhanced hydrogen evolution reaction in all pH values[期刊论文]，Journal of Colloid and Interface Science，2023-01-01
  • 8. DOI Cao, Dong;Shao, Jie;Cui, Yahui;Zhang, Lipeng;Cheng, Daojian
    Interfacial Engineering of Copper–Nickel Selenide Nanodendrites for Enhanced Overall Water Splitting in Alkali Condition[期刊论文]，Small，2023-01-01
  • 9. DOI Wang, Xuning;Xu, Haoxiang;Luo, Yibin;Cheng, Daojian
    High Selective Direct Synthesis of H2O2 over Pd-1@gamma-Al2O3 Single-Atom Catalyst[期刊论文]，CHEMCATCHEM，2022-11-08
  • 10. DOI Deng, Zhuoran;Zhao, Liqiang;Cheng, Daojian
    A high-throughput catalyst synthesis system for Ag-based catalysts[期刊论文]，Review of Scientific Instruments，2022-11-01
  • 11. DOI Xu, Xiaopei;Peng, Zhipeng;Xu, Haoxiang;Cheng, Daojian
    Computational screening of nonmetal dopants to active MoS2 basal-plane for hydrogen evolution reaction via structural descriptor[期刊论文]，Journal of Catalysis，2022-10-31
  • 12. DOI 曹东,许昊翔,Hongliang Li,Chen Feng,Jie Zeng,程道建
    Volcano-type relationship between oxidation states and catalytic activity of single-atom catalysts towards hydrogen evolution[期刊论文]，Nature Communications，2022-10-04
  • 13. DOI Yan, Jingjing;Xu, Haoxiang;Chang, Le;Lin, Aijun;Cheng, Daojian
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single-atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 14. DOI 燕晶晶,许昊翔,常乐,林爱军,程道建
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 15. DOI Cheng, Feipeng;Cheng, Jihao;Nan, Yang;Xie, Yuan;Yang, Tongqian;Cheng, Daojian;Zhu, Jiqin;Xu, Haoxiang
    Enhancing oxidative hydration of ethylene towards ethylene glycol over metal-modified titanosilicate catalysts[期刊论文]，Applied Catalysis A: General，2022-08-05
  • 16. DOI Wen, Qi-Xing;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Design of CuCs-doped Ag-based catalyst for ethylene epoxidation[期刊论文]，Chinese Journal of Chemical Physics，2022-08-01
  • 17. DOI 张眉佳,许昊翔,罗一斌,朱吉钦,程道建
    Enhancing the catalytic performance of PdAu catalysts by W induced strong interaction for the direct synthesis of H2O2[期刊论文]，Catalysis Science & Technology，2022-07-26
  • 18. DOI Deng, Zhuoran;Zhou, Yingcheng;Zhao, Liqiang;Cheng, Daojian
    Structures and structural evolution of M-N (M = Pt, Ag, Au, N=2-20) from combined revised particle swarm optimization and density function theory[期刊论文]，MOLECULAR SIMULATION，2022-07-03
  • 19. DOI Zhang, Huimin;Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Carbon-based material-supported single-atom catalysts for energy conversion[期刊论文]，ISCIENCE，2022-06-17
  • 20. DOI 陈志强;车春霞;吴登峰;温翯;韩伟;张峰;许昊翔;程道建
    乙炔选择性加氢催化剂研究进展[期刊论文]，化工进展，2022-03-17
  • 21. DOI Liu, Ning;Cao, Dong;Liu, Wenhao;Zhang, Huimin;Zhu, Yinhai;Chang, Le;Wu, Dengfeng;Cheng, Daojian
    Constructing La-doped ultrathin Co-based nanostructured electrocatalysts for high-performance water oxidation process[期刊论文]，International Journal of Hydrogen Energy，2022-01-01
  • 22. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Branch-leaf-shaped CuNi@NiFeCu nanodendrites as highly efficient electrocatalysts for overall water splitting[期刊论文]，Applied Catalysis B-Environmental，2021-12-05
  • 23. DOI Zhang, Meijia;Luo, Yibin;Wu, Dengfeng;Li, Qian;Xu, Haoxiang;Cheng, Daojian
    Promoter role of tungsten in W-Pd/Al2O3 catalyst for direct synthesis of H2O2: Modification of Pd/PdO ratio[期刊论文]，APPLIED CATALYSIS A-GENERAL，2021-11-25
  • 24. DOI 孙晋冬;展学成;吴登峰;谢元;马好文;许昊翔;程道建
    碳四炔烃选择性加氢催化剂研究进展[期刊论文]，石油学报(石油加工)，2021-10-15
  • 25. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Construction of Dual-Site Atomically Dispersed Electrocatalysts with Ru-C-5 Single Atoms and Ru-O-4 Nanoclusters for Accelerated Alkali Hydrogen Evolution[期刊论文]，Small，2021-08-01
  • 26. DOI Cao, Dong;Wang, Jiayi;Zhang, Huimin;Xu, Haoxiang;Cheng, Daojian
    Growth of IrCu nanoislands with rich IrCu/Ir interfaces enables highly efficient overall water splitting in non-acidic electrolytes[期刊论文]，Chemical Engineering Journal，2021-07-15
  • 27. DOI Zhu, Yinhai;Cao, Dong;Liu, Ning;Cheng, Daojian
    One-step synthesis of atomic Ru doped ultra-thin Co(OH)(2) nanosheets for oxygen evolution reaction in different pH values[期刊论文]，International Journal of Hydrogen Energy，2021-06-28
  • 28. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Metal Dopants in Enhancing the Selectivity of Ag-Catalyzed Ethylene Epoxidation: Optimizing Oxophilicity of Reaction Site via Cocatalytic Mechanism[期刊论文]，ACS Catalysis，2021-03-19
  • 29. DOI 吴建国;吴登峰;程道建
    丙烷脱氢制丙烯用单原子催化剂研究进展[期刊论文]，化工进展，2021-03-16
  • 30. DOI Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Review on Synthesis and Catalytic Coupling Mechanism of Highly Active Electrocatalysts for Water Splitting[期刊论文]，Energy Technology，2021-02-01
  • 31. DOI Ma, Haowen;Xu, Xiaopei;Xu, Haoxiang;Feng, Huixia;Xie, Yuan;Cheng, Daojian
    Understanding composition-dependent catalytic performance of PdAg for the hydrogenation of 1,3-butadiene to 1-butene[期刊论文]，CATALYSIS COMMUNICATIONS，2021-01-15
  • 32. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文]，Advances in Physics-X，2021-01-01
  • 33. DOI Huang, Xingkai;Xu, Haoxiang;Cao, Dong;Cheng, Daojian
    Interface construction of P-Substituted MoS2 as efficient and robust electrocatalyst for alkaline hydrogen evolution reaction[期刊论文]，Nano Energy，2020-12-01
  • 34. DOI Yang, Liu,许昊翔,Liu, Huibing,曾晓飞,程道建,黄燕,Zheng, Lirong,Cao, Rui,曹达鹏
    Oxygen-Reconstituted Active Species of Single-Atom Cu Catalysts for Oxygen Reduction Reaction[期刊论文]，Research，2020-10-05
  • 35. DOI Xu, Xiaopei,许昊翔,程道建
    Identification of the Anti-triangular Etched MoS2 with Comparative Activity with Commercial Pt for Hydrogen Evolution Reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-10-04
  • 36. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Growth of Highly Active Amorphous RuCu Nanosheets on Cu Nanotubes for the Hydrogen Evolution Reaction in Wide pH Values[期刊论文]，Small，2020-09-01
  • 37. DOI 许昊翔,程道建
    First-principles-aided Thermodynamic Modeling of Transition-metal Heterogeneous Catalysts: A review.[期刊论文]，Green Energy & Environment，2020-07-14
  • 38. DOI Xu, Haoxiang;Cheng, Daojian
    First-principles-aided thermodynamic modeling of transition-metal heterogeneous catalysts: A review[期刊论文]，GREEN ENERGY & ENVIRONMENT，2020-07-01
  • 39. DOI Che, Chunxia;Xu, Haoxiang;Wen, He;Gou, Galian;Cheng, Daojian
    Theoretical Study on the Structural, Thermal and Phase Stability of Pt-Cu Alloy Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2020-05-01
  • 40. DOI Zhang, Wei;Zhu, Jiqin;Cheng, Daojian;Zeng, Xiao Cheng
    PtCoNi Alloy Nanoclusters for Synergistic Catalytic Oxygen Reduction Reaction[期刊论文]，ACS APPLIED NANO MATERIALS，2020-03-01
  • 41. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Construction of Defect-Rich RhCu Nanotubes with Highly Active Rh3Cu1 Alloy Phase for Overall Water Splitting in All pH Values[期刊论文]，ADVANCED ENERGY MATERIALS，2020-03-01
  • 42. DOI Wu, Dengfeng;Zhang, Wei;Lin, Aijun;Cheng, Daojian
    Low Pt-Content Ternary PtNiCu Nanoparticles with Hollow Interiors and Accessible Surfaces as Enhanced Multifunctional Electrocatalysts[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2020-02-26
  • 43. DOI Wu, Dengfeng;Yang, Yang;Dai, Changqing;Cheng, Daojian
    Enhanced oxygen reduction activity of PtCu nanoparticles by morphology tuning and transition-metal doping[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-02-07
  • 44. DOI Huang, Xingkai;Xu, Xiaopei;Luan, Xiaoxu;Cheng, Daojian
    CoP nanowires coupled with CoMoP nanosheets as a highly efficient cooperative catalyst for hydrogen evolution reaction[期刊论文]，NANO ENERGY，2020-02-01
  • 45. DOI Zhou, Yingcheng;Zhao, Zheng;Cheng, Daojian
    Cluster structure prediction via revised particle-swarm optimization algorithm[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2020-02-01
  • 46. DOI Li, Lin-Xin;Xie, Zhi-Hui;Fernandez, Carlos;Wu, Liang;Cheng, Daojian;Jiang, Xiao-Hui;Zhong, Chuan-Jian
    Development of a thiophene derivative modified LDH coating for Mg alloy corrosion protection[期刊论文]，ELECTROCHIMICA ACTA，2020-01-10
  • 47. DOI Zhang, Junmeng;Xu, Xiaopei;Yang, Liu;Cheng, Daojian;Cao, Dapeng
    Single-Atom Ru Doping Induced Phase Transition of MoS2 and S Vacancy for Hydrogen Evolution Reaction[期刊论文]，SMALL METHODS，2019-12-11
  • 48. DOI Zhao, Zheng,许昊翔,Feng, Zongyu,Zhang, Yongqi,Cui, Meisheng,曹达鹏,程道建
    Design of High-Performance Co-Based Alloy Nanocatalysts for the Oxygen Reduction Reaction[期刊论文]，Chemistry - A European Journal，2019-12-03
  • 49. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Chlorine in Selectivity Enhancement of Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-11-27
  • 50. DOI Xu, Xiaopei;Xu, Haoxiang;Cheng, Daojian
    Design of high-performance MoS2 edge supported single-metal atom bifunctional catalysts for overall water splitting via a simple equation[期刊论文]，NANOSCALE，2019-11-14
  • 51. DOI Wu, Dengfeng;Cheng, Daojian
    Structure-controlled synthesis of one-dimensional PdCu nanoscatalysts via a seed-mediated approach for oxygen reduction reaction[期刊论文]，APPLIED SURFACE SCIENCE，2019-11-01
  • 52. DOI Huang, Xiaoyu;Yang, Yang;Cheng, Daojian
    Hydrogen generation from formic acid decomposition on Pd-Cu nanoalloys[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-09-13
  • 53. DOI Zhang, Wei;Deibert, David L.;Cheng, Daojian;Zeng, Xiao Cheng
    Magnetism in bimetallic PtxNiN-x clusters via cross-atomic coupling[期刊论文]，JOURNAL OF MATERIALS CHEMISTRY C，2019-08-14
  • 54. DOI Ma, Haowen;Yang, Yang;Feng, Huixia;Cheng, Daojian
    DFT Study of Pyrolysis Gasoline Hydrogenation on Pd(100), Pd(110) and Pd(111) Surfaces[期刊论文]，CATALYSIS LETTERS，2019-08-01
  • 55. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Fortunelli, Alessandro;Cheng, Daojian
    Selectivity-Driven Design of the Ag-Cu Alloys for the Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-07-24
  • 56. DOI Cao, Dong;Cheng, Daojian
    One-pot synthesis of copper-nickel sulfide nanowires for overall water splitting in alkaline media[期刊论文]，CHEMICAL COMMUNICATIONS，2019-07-18
  • 57. DOI Huang, Xingkai;Xu, Xiaopei;Li, Chao;Wu, Dengfeng;Cheng, Daojian;Cao, Dapeng
    Vertical CoP Nanoarray Wrapped by N,P-Doped Carbon for Hydrogen Evolution Reaction in Both Acidic and Alkaline Conditions[期刊论文]，ADVANCED ENERGY MATERIALS，2019-06-01
  • 58. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Cheng, Daojian
    The synergistic effect between crystal planes and promoters on Ag-catalyzed ethylene epoxidation[期刊论文]，APPLIED SURFACE SCIENCE，2019-05-15
  • 59. DOI Yang, Liu;Xu, Haoxiang;Liu, Huibing;Cheng, Daojian;Cao, Dapeng
    Active Site Identification and Evaluation Criteria of In Situ Grown CoTe and NiTe Nanoarrays for Hydrogen Evolution and Oxygen Evolution Reactions[期刊论文]，SMALL METHODS，2019-05-10
  • 60. DOI Yang, Chenxi;Wang, Guoqing;Liang, Aimin;Yue, Yi;Peng, Hui;Cheng, Daojian
    Understanding the role of Au in the selective hydrogenation of acetylene on trimetallic PdAgAu catalytic surface[期刊论文]，CATALYSIS COMMUNICATIONS，2019-05-05
  • 61. DOI Li, Pengcheng;Wu, Dengfeng;Dai, Changqing;Huang, Xingkai;Li, Chao;Yin, Zhen;Zhou, Song;Lv, Zhengang;Cheng, Daojian;Zhu, Jiqin;Xu, Jian;Liu, Xi
    Controlled Synthesis of Copper-Doped Molybdenum Carbide Catalyst with Enhanced Activity and Stability for Hydrogen Evolution Reaction[期刊论文]，CATALYSIS LETTERS，2019-05-01
  • 62. DOI Elouarzaki Kamal,Wang Yian,Kannan Vishvak,许昊翔,程道建,Lee Jong-Min,Fisher Adrian C.
    Hydrogenase-Like Electrocatalytic Activation and Inactivation Mechanism by Three-Dimensional Binderless Molecular Catalyst[期刊论文]，ACS Applied Energy Materials，2019-04-09
  • 63. DOI Xu, Haoxiang;Cheng, Daojian
    Rational design of transition metal nanocatalyst by structure descriptor[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2019-03-31
  • 64. DOI Yang, Mengjie;Wu, Dengfeng;Cheng, Daojian
    Biomass-derived porous carbon supported Co-CoO yolk-shell nanoparticles as enhanced multifunctional electrocatalysts[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-03-08
  • 65. DOI Zhao, Zheng;Kong, Kewei;Wang, Shixian;Zhou, Yingcheng;Cheng, Daojian;Wang, Wenchuan;Zeng, Xiao Cheng;Li, Hui
    Understanding Hygroscopic Nucleation of Sulfate Aerosols: Combination of Molecular Dynamics Simulation with Classical Nucleation Theory[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY LETTERS，2019-03-07
  • 66. DOI Lv, Yanlong,朱琳,许昊翔,Yang, Liu,刘志平,程道建,Cao, Xiaohua,Yun Jimmy,曹达鹏
    Core/shell Template-derived Co, N-doped Carbon Bifunctional Electrocatalysts for Rechargeable Zn-air Battery[期刊论文]，Engineered Science，2019-02-28
  • 67. DOI Zhao, Zheng;Xu, Haoxiang;Gao, Yi;Cheng, Daojian
    Universal description of heating-induced reshaping preference of core-shell bimetallic nanoparticles[期刊论文]，NANOSCALE，2019-01-21
  • 68. DOI Yang, Yang,Zhao, Zheng,程道建,朱吉钦
    Effect of Size and Composition on the Structural Stability of Pt–Ni Nanoalloys[期刊论文]，Journal of Cluster Science，2019-01-14
  • 69. DOI Nan, Yang;Wang, Yinuo;Cao, Dong;Yang, Yang;Cheng, Daojian
    Adsorption and dissociation of borohydride on different Ir-Ni alloy surfaces[期刊论文]，Appl Surf Sci，2019-01-01
  • 70. DOI Yang, Yang,许昊翔,曹达鹏,曾晓成,程道建
    Hydrogen Production via Efficient Formic Acid Decomposition: Engineering the Surface Structure of Pd-Based Alloy Catalysts by Design[期刊论文]，ACS Catalysis，2018-12-07
  • 71. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Zhu, Jiqin;Cheng, Daojian
    Facet-dependent diffusion of atomic oxygen on Ag surfaces[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2018-12-01
  • 72. DOI Chang, Le;Cheng, Daojian;Sementa, Luca;Fortunelli, Alessandro
    Hydrogen evolution reaction (HER) on Au@Ag ultrananoclusters as electro-catalysts[期刊论文]，NANOSCALE，2018-10-07
  • 73. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi;Zeng, Xiao Cheng
    Assessment of Catalytic Activities of Gold Nanoclusters with Simple Structure Descriptors[期刊论文]，ACS CATALYSIS，2018-10-01
  • 74. DOI Yang, Yang;Dai, Changqing;Wu, Dengfeng;Liu, Zhiping;Cheng, Daojian
    The Size Effect of PdCu Bimetallic Nanoparticles on Oxygen Reduction Reaction Activity[期刊论文]，CHEMELECTROCHEM，2018-09-12
  • 75. DOI Lian, Xiaojun;Niu, Mang;Huang, Yan;Cheng, Daojian
    MoS2-CdS heterojunction with enhanced photocatalytic activity: A first principles study[期刊论文]，JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS，2018-09-01
  • 76. DOI Huang, Yichao;Hu, Jun;Xu, Haoxiang;Bian, Wei;Ge, Jingxuan;Zang, Dejin;Cheng, Daojian;Lv, Yaokang;Zhang, Cheng;Gu, Jing;Wei, Yongge
    Fine Tuning Electronic Structure of Catalysts through Atomic Engineering for Enhanced Hydrogen Evolution[期刊论文]，ADVANCED ENERGY MATERIALS，2018-08-27
  • 77. DOI Miao, Xue-Pei;Cheng, Dao-Jian;Dai, Ya-Dong;Meng, Yan;Li, Xiao-Yu
    Origin of Modulus Improvement for Epoxide-terminated Hyperbranched Poly(ether sulphone)/DGEBA/TETA Systems[期刊论文]，CHINESE JOURNAL OF POLYMER SCIENCE，2018-08-01
  • 78. DOI Chang, Le;Baseggio, Oscar;Sernenta, Luca;Cheng, Daojian;Fronzoni, Giovanna;Toffoli, Daniele;Apra, Edoardo;Stener, Mauro;Fortunelli, Alessandro
    Individual Component Map of Rotatory Strength and Rotatory Strength Density Plots As Analysis Tools of Circular Dichroism Spectra of Complex Systems[期刊论文]，JOURNAL OF CHEMICAL THEORY AND COMPUTATION，2018-07-01
  • 79. DOI Elouarzaki, Kamal;Cheng, Daojian;Fisher, Adrian C.;Lee, Jong-Min
    Coupling orientation and mediation strategies for efficient electron transfer in hybrid biofuel cells[期刊论文]，NATURE ENERGY，2018-07-01
  • 80. DOI Wang, Zegao;Li, Qiang;Xu, Haoxiang;Dahl-Petersen, Christian;Yang, Qian;Cheng, Daojian;Cao, Dapeng;Besenbacher, Flemming;Lauritsen, Jeppe V.;Helveg, Stig;Dong, Mingdong
    Controllable etching of MoS2 basal planes for enhanced hydrogen evolution through the formation of active edge sites[期刊论文]，NANO ENERGY，2018-07-01
  • 81. DOI Yang, Liu;Cheng, Daojian;Zeng, Xiaofei;Wan, Xin;Shui, Jianglan;Xiang, Zhonghua;Cao, Dapeng
    Unveiling the high-activity origin of single-atom iron catalysts for oxygen reduction reaction[期刊论文]，PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA，2018-06-26
  • 82. DOI 杨洋,Yu, Haiyan,Cai, Yushun,Ferrando, Riccardo,程道建
    Origin of enhanced stability and oxygen adsorption capacity of mediumsized Pt–Ni nanoclusters[期刊论文]，Journal of Physics: Condensed Matter，2018-06-22
  • 83. DOI Yu, Haiyan,Yang, Liu,程道建,曹达鹏
    Zeolitic-imidazolate Framework (ZIF)@ZnCo-ZIF Core-shell Template Derived Co, N-doped Carbon Catalysts for Oxygen Reduction Reaction[期刊论文]，Engineered Science，2018-06-02
  • 84. DOI 吴登峰,Zhang, Xin,朱吉钦,程道建
    Concerted Catalysis on Tanghulu-like Cu@Zeolitic Imidazolate Framework-8 (ZIF-8) Nanowires with Tuning Catalytic Performances for 4-nitrophenol Reduction[期刊论文]，Engineered Science，2018-05-21
  • 85. DOI Huang, Yan;Wu, Dengfeng;Cao, Dapeng;Cheng, Daojian
    Facile preparation of biomass-derived bifunctional electrocatalysts for oxygen reduction and evolution reactions[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2018-05-03
  • 86. DOI Xu, Haoxiang;Cheng, Daojian;Cao, Dapeng;Zeng, Xiao Cheng
    A universal principle for a rational design of single-atom electrocatalysts[期刊论文]，NATURE CATALYSIS，2018-05-01
  • 87. DOI Li, Zhenhao;Zhu, Lin;Chen, Jian-Feng;Cheng, Daojian
    Enhanced Ethylene Oxide Selectivity by Cu and Re Dual-Promoted Ag Catalysts[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2018-03-28
  • 88. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian
    Enhanced photochemical performance of hexagonal WO3 by metal-assisted S-O coupling for solar-driven water splitting[期刊论文]，SCIENCE CHINA-MATERIALS，2018-01-01
  • 89. DOI Xu, Haoxiang;Xu, Cong-Qiao;Cheng, Daojian;Li, Jun
    Identification of activity trends for CO oxidation on supported transition-metal single-atom catalysts[期刊论文]，CATALYSIS SCIENCE & TECHNOLOGY，2017-12-21
  • 90. DOI Ren, Dongmei;Cheng, Gang;Li, Jianwei;Li, Jinbing;Dai, Wujun;Sun, XinXin;Cheng, Daojian
    Effect of Rhenium Loading Sequence on Selectivity of Ag-Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-12-01
  • 91. DOI Huang, Xingkai;Wu, Dengfeng;Cheng, Daojian
    Porous Co2P nanowires as high efficient bifunctional catalysts for 4-nitrophenol reduction and sodium borohydride hydrolysis[期刊论文]，JOURNAL OF COLLOID AND INTERFACE SCIENCE，2017-12-01
  • 92. DOI Ren, Dongmei;Xu, Haoxiang;Li, Jianwei;Li, Jinhing;Cheng, Daojian
    Origin of enhanced ethylene oxide selectivity by Cs-promoted silver catalyst[期刊论文]，MOLECULAR CATALYSIS，2017-11-01
  • 93. DOI Wei, Yongsheng;Huang, Xingkai;Wang, Junyan;Yu, Haiyan;Zhao, Xinsheng;Cheng, Daojian
    Synthesis of bifunctional non-noble monolithic catalyst Co-W-P/carbon cloth for sodium borohydride hydrolysis and reduction of 4-nitrophenol[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2017-10-12
  • 94. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 95. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 96. DOI Yan, Bailu;Zhao, Zheng;Zhou, Yingcheng;Yuan, Wenyan;Li, Jian;Wu, Jun;Cheng, Daojian
    A particle swarm optimization algorithm with random learning mechanism and Levy flight for optimization of atomic clusters[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2017-10-01
  • 97. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 98. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 99. DOI Yang, Yang;Dai, Changqing;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    A full understanding of oxygen reduction reaction mechanism on Au(111) surface[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2017-09-13
  • 100. DOI Shan, Aixian;Chen, Chinping;Zhang, Wei;Cheng, Daojian;Shen, Xi;Yu, Richeng;Wang, Rongming
    Giant enhancement and anomalous temperature dependence of magnetism in monodispersed NiPt2 nanoparticles[期刊论文]，NANO RESEARCH，2017-09-01
  • 101. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 102. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 103. DOI Zhang, Xing;Wu, Dengfeng;Cheng, Daojian
    Component-dependent electrocatalytic activity of PdCu bimetallic nanoparticles for hydrogen evolution reaction[期刊论文]，ELECTROCHIMICA ACTA，2017-08-20
  • 104. DOI Zhao, Zheng;Wang, Fang-Hui;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Phase stability and segregation behavior of nickel-based nanoalloys based on theory and simulation[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2017-06-25
  • 105. DOI Wu, Dengfeng;Zhang, Wei;Cheng, Daojian
    Facile Synthesis of Cu/NiCu Electrocatalysts Integrating Alloy, Core Shell, and One-Dimensional Structures for Efficient Methanol Oxidation Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2017-06-14
  • 106. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 107. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 108. DOI Zhang, Wei;Shan, Shiyao;Luo, Jin;Fisher, Adrian;Chen, Jian-Feng;Zhong, Chuan-Jian;Zhu, Jiqin;Chen, Daojian
    Origin of Enhanced Activities for CO Oxidation and O-2 Reaction over Composition-Optimized Pd50Cu50 Nanoalloy Catalysts[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2017-05-25
  • 109. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin;Cheng, Daojian
    Mechanistic insight into the facet-dependent selectivity of ethylene epoxidation on Ag nanocatalysts[期刊论文]，APPLIED CATALYSIS A: GENERAL，2017-05-25
  • 110. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin
    Ni (111)-supported graphene as a potential catalyst for high-efficient CO oxidation[期刊论文]，CARBON，2017-05-01
  • 111. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi
    Design of High-Performance Pd-Based Alloy Nanocatalysts for Direct Synthesis of H2O2[期刊论文]，ACS CATALYSIS，2017-03-01
  • 112. DOI Yu, Haiyan;Cao, Dapeng;Fisher, Adrian;Johnston, Roy L.;Cheng, Daojian
    Size effect on the adsorption and dissociation of CO2 on Co nanoclusters[期刊论文]，APPLIED SURFACE SCIENCE，2017-02-28
  • 113. DOI Lian, Xiaojun;Zhao, Zheng;Cheng, Daojian
    Recent progress on triphenylamine materials: synthesis, properties, and applications[期刊论文]，MOLECULAR CRYSTALS AND LIQUID CRYSTALS，2017-01-01
  • 114. DOI Wu, Dengfeng;Xu, Haoxiang;Cao, Dapeng;Fisher, Adrian;Gao, Yi;Cheng, Daojian
    PdCu alloy nanoparticle-decorated copper nanotubes as enhanced electrocatalysts: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-12-09
  • 115. DOI Dai, Changqing;Yang, Yang;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Interaction of CO2 with metal cluster-functionalized ionic liquids[期刊论文]，JOURNAL OF CO2 UTILIZATION，2016-12-01
  • 116. DOI Wei, Chengcheng;Zhao, Zheng;Fisher, Adrian;Zhu, Jiqin;Cheng, Daojian
    Theoretical Study on the Structures and Thermal Properties of Ag-Pt-Ni Trimetallic Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-11-01
  • 117. DOI Cheng, Daojian;Wu, Dengfeng;Xu, Haoxiang;Fisher, Adrian
    Composition-controlled Synthesis of PtCuNPs Shells on Copper Nanowires as Electrocatalysts[期刊论文]，CHEMISTRYSELECT，2016-09-16
  • 118. DOI Yu, Haiyan;Fisher, Adrian;Cheng, Daojian;Cao, Dapeng
    Cu,N-codoped Hierarchical Porous Carbons as Electrocatalysts for Oxygen Reduction Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2016-08-24
  • 119. DOI Yang, Yang;Dai, Changqing;Shen, Yanchun;Fisher, Adrian;Cheng, Daojian
    Design of binary and ternary platinum shelled electrocatalysts with inexpensive metals for the oxygen reduction reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2016-08-10
  • 120. DOI Liu, Xinyue;Dai, Changqing;Wu, Dengfeng;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Facile Synthesis of PdAgCo Trimetallic Nanoparticles for Formic Acid Electrochemical Oxidation[期刊论文]，CHEMISTRY LETTERS，2016-07-05
  • 121. DOI 程道建
    双金属纳米电催化:理论和实验研究[会议论文]，中国化学会第30届学术年会摘要集-第二十九分会：电化学材料，2016-07-01
  • 122. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    A density functional theory study of sulfur adsorption on Ag-Au nanoalloys[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2016-06-01
  • 123. DOI 程道建
    双金属纳米催化:理论和实验研究[会议论文]，第七届全国物理无机化学学术会议论文集，2016-05-06
  • 124. DOI Zhao, Zheng;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Magnetic Properties of Pt-Based Nanoalloys: A Critical Review[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-05-01
  • 125. DOI Zhao, Zheng;Fisher, Adrian;Cheng, Daojian
    Phase diagram and segregation of Ag-Co nanoalloys: insights from theory and simulation[期刊论文]，NANOTECHNOLOGY，2016-03-18
  • 126. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Huan, Haifeng;Cao, Dapeng
    Enhanced near-infrared shielding ability of (Li, K)-codoped WO3 for smart windows: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-02-09
  • 127. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Highly sensitive and selective colorimetric detection of sulphide using Ag-Au nanoalloys: a DFT study[期刊论文]，RSC ADVANCES，2016-01-01
  • 128. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文]，MOLECULAR SIMULATION，2016-01-01
  • 129. DOI Chang, Le;Liu, Zhiping;Cheng, Daojian
    Optical properties of Ag-Au nanoclusters for sulphide sensing from TDDFT calculations[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2015-12-25
  • 130. DOI Zhang, Wei;Cui, Rong;Wu, Hao;Zhu, Jiqin;Cheng, Daojian
    CO oxidation mechanism on a MgO(100) supported PtxAu3-x clusters[期刊论文]，APPLIED SURFACE SCIENCE，2015-11-30
  • 131. DOI Zhang, Wei;Sumer, Aslihan;Jellinek, Julius;Cheng, Daojian
    Morphology Tailoring of Pt Nanocatalysts for the Oxygen Reduction Reaction: The Paradigm of Pt-13[期刊论文]，CHEMNANOMAT，2015-11-01
  • 132. DOI Wu, Dengfeng;Cheng, Daojian
    Core/shell AgNi/PtAgNi nanoparticles as methanol-tolerant oxygen reduction electrocatalysts[期刊论文]，ELECTROCHIMICA ACTA，2015-10-20
  • 133. DOI wang,qian,fang,yu,孟洪,毋伟,初广文,邹海魁,程道建,陈建峰
    Enhanced simulated sunlight induced photocatalytic activity by pomegranate-like S doped SnO2@TiO2 spheres[期刊论文]，Colloids and Surfaces A: Physicochemical and Engineering Aspects，2015-10-05
  • 134. DOI Niu, Mang;Tan, Huaqiao;Cheng, Daojian;Sun, Zaicheng;Cao, Dapeng
    Bandgap engineering of Magnei phase TinO2n-1: Electron-hole self-compensation[期刊论文]，JOURNAL OF CHEMICAL PHYSICS，2015-08-07
  • 135. DOI Wu, Dengfeng;Dai, Changqing;Li, Shaojie;Cheng, Daojian
    Shape-controlled Synthesis of PdCu Nanocrystals for Formic Acid Oxidation[期刊论文]，CHEMISTRY LETTERS，2015-08-05
  • 136. DOI Niu, Mang;Cui, Rong;Wu, Hao;Cheng, Daojian;Cao, Dapeng
    Enhancement Mechanism of the Conversion Effficiency of Dye-Sensitized Solar Sells Based on Nitrogen-, Fluorine-, and Iodine-Doped TiO2 Photoanodes[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-06-18
  • 137. DOI Yang, Yang;Zhao, Zheng;Cui, Rong;Wu, Hao;Cheng, Daojian
    Structures, Thermal Stability, and Chemical Activity of Crown-Jewel-Structured Pd-Pt Nanoalloys[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-05-21
  • 138. DOI Wang, Jian;Yuan, Wenyan;Cheng, Daojian
    Hybrid genetic-particle swarm algorithm: An efficient method for fast optimization of atomic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2015-05-01
  • 139. DOI Xu, Haoxiang;Cheng, Daojian
    Effect of the Passivating Ligands on the Geometric and Electronic Properties of Au-Pd Nanoalloys[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2015-05-01
  • 140. DOI Chen, Bing;Cheng, Daojian;Zhu, Jiqin
    Synthesis of PtCu nanowires in nonaqueous solvent with enhanced activity and stability for oxygen reduction reaction[期刊论文]，JOURNAL OF POWER SOURCES，2014-12-01
  • 141. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Cao, Dapeng
    Design of the Alkali-Metal-Doped WO3 as a Near-Infrared Shielding Material for Smart Window[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2014-11-19
  • 142. DOI Li, Shaojie;Cheng, Daojian;Qiu, Xiangguo;Cao, Dapeng
    Synthesis of Cu@Pd core-shell nanowires with enhanced activity and stability for formic acid oxidation[期刊论文]，ELECTROCHIMICA ACTA，2014-10-10
  • 143. DOI Chang, Le;Xu, Haoxiang;Cheng, Daojian
    Role of ligand type on the geometric and electronic properties of Ag-Au bimetallic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2014-10-01
  • 144. DOI Zhao, Zheng;Li, Mingjiang;Cheng, Daojian;Zhu, Jiqin
    Understanding the structural properties and thermal stabilities of Au-Pd-Pt trimetallic clustersle[期刊论文]，CHEMICAL PHYSICS，2014-09-30
  • 145. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Fluorite TiO2(111) Surface Phase for Enhanced Visible-Light Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-09-04
  • 146. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    SiH/TiO2 and GeH/TiO2 Heterojunctions: Promising TiO2-based Photocatalysts under Visible Light[期刊论文]，SCIENTIFIC REPORTS，2014-05-02
  • 147. DOI Cheng, Daojian;Xu, Haoxiang;Fortunelli, Alessandro
    Tuning the catalytic activity of Au-Pd nanoalloys in CO oxidation via composition[期刊论文]，JOURNAL OF CATALYSIS，2014-05-01
  • 148. DOI Fang, Yu;Cheng, Daojian;Wu, Wei
    Understanding electronic and optical properties of N-Sn codoped anatase TiO2[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-04-01
  • 149. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding the Mechanism of Photocatalysis Enhancements in the Graphene-like Semiconductor Sheet/TiO2 Composites[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-03-20
  • 150. DOI Cheng, Daojian;Zhang, Minming;Chen, Jianfeng;Yang, Chenxi;Zeng, Xiaofei;Cao, Dapeng
    Computer Screening of Dopants for the Development of New SnO2-Based Transparent Conducting Oxides[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-30
  • 151. DOI Yang, Yang;Cheng, Daojian
    Role of Composition and Geometric Relaxation in CO2 Binding to Cu-Ni Bimetallic Clusters[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-09
  • 152. DOI Zhang, Wei;Cheng, Daojian;Zhu, Jiqin
    Theoretical study of CO catalytic oxidation on free and defective graphene-supported Au-Pd bimetallic clusters[期刊论文]，RSC ADVANCES，2014-01-01
  • 153. DOI Cheng, Daojian;Qiu, Xiangguo;Yu, Haiyan
    Enhancing oxygen reduction reaction activity of Pt-shelled catalysts via subsurface alloying[期刊论文]，PHYSICAL CHEMISTRY CHEMICAL PHYSICS，2014-01-01
  • 154. DOI Tan, Huaqiao;Zhao, Zhao;Niu, Mang;Mao, Chengyu;Cao, Dapeng;Cheng, Daojian;Feng, Pingyun;Sun, Zaicheng
    A facile and versatile method for preparation of colored TiO2 with enhanced solar-driven photocatalytic activity[期刊论文]，NANOSCALE，2014-01-01
  • 155. DOI Li, Mingjiang;Li, Shaojie;Cheng, Daojian
    Influence of adsorbates on the segregation properties of Au-Pd bimetallic clusters[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-01-01
  • 156. DOI Li, Mingjiang;Cheng, Daojian
    Molecular Dynamics Simulation of the Melting Behavior of Crown-Jewel Structured Au-Pd Nanoalloys[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-09-12
  • 157. DOI Cheng, Daojian;Yuan, Shuai;Ferrando, Riccardo
    Structure, chemical ordering and thermal stability of Pt-Ni alloy nanoclusters[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2013-09-04
  • 158. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding Photoelectrochennical Properties of B-N Codoped Anatase TiO2 for Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-08-08
  • 159. DOI Cheng, Daojian;Negreiros, Fabio R.;Apra, Edoardo;Fortunelli, Alessandro
    Computational Approaches to the Chemical Conversion of Carbon Dioxide[期刊论文]，CHEMSUSCHEM，2013-06-01
  • 160. DOI Fang, Yu;Cheng, Daojian;Niu, Mang;Yi, Yongjun;Wu, Wei
    Tailoring the electronic and optical properties of rutile TiO2 by (Nb + Sb, C) codoping from DFT plus U calculations[期刊论文]，CHEMICAL PHYSICS LETTERS，2013-04-19
  • 161. DOI Cheng, Daojian;Cao, Dapeng;Wang, Wenchuan
    Hydrogen storage in porous materials and nanoalloys as catalysts for fuel cell application by using multiscale simulation and experimental methods[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2013-04-07
  • 162. DOI Cheng, Daojian;Jiang, Kun
    Structural stability and kinetics of small carbon clusters on a bimetallic Cu/Ni(111) surface: A first-principles study[期刊论文]，SURFACE SCIENCE，2013-03-01
  • 163. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Enhanced photoelectrochemical performance of anatase TiO2 by metal-assisted S-O coupling for water splitting[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2013-02-06
[+][-] 2029年
  • 1. DOI Zhang, Huimin;Liu, Wenhao;Li, Zhenhao;Qiao, Liang;Chi, Kebin;Guo, Xiaoyan;Cao, Dong;Cheng, Daojian
    Constructing CoP/Ni2P Heterostructure Confined Ru Sub-Nanoclusters for Enhanced Water Splitting in Wide pH Conditions[期刊论文]，Advanced Science，2024-09-18
  • 2. DOI Cao, Dong;Zhang, Zhirong;Cui, Yahui;Zhang, Runhao;Zhang, Lipeng;Zeng, Jie;Cheng, Daojian
    One-Step Approach for Constructing High-Density Single-Atom Catalysts toward Overall Water Splitting at Industrial Current Densities[期刊论文]，Angewandte Chemie-International Edition，2023-02-20
  • 3. DOI Sun, Jindong;Xu, Haoxiang;Ma, Haowen;Zhan, Xuecheng;Zhu, Jiqin;Cheng, Daojian
    Isoprene selective hydrogenation using AgCu-promoted Pd nanoalloys[期刊论文]，FARADAY DISCUSSIONS，2023-01-31
  • 4. DOI Liu, Tianpeng;Liu, Wenhao;Ma, Mengyao;Guo, Linke;Cui, Rong;Cheng, Daojian;Cao, Dong
    Constructing nickel vanadium phosphide nanoarrays with highly active heterointerfaces for water oxidation in alkali media[期刊论文]，ELECTROCHIMICA ACTA，2023-01-20
  • 5. DOI Cao, Dong;Huang, Xiaoyu;Zhang, Huimin;Liu, Wenhao;Cheng, Daojian
    Constructing porous RuCu nanotubes with highly efficient alloy phase for water splitting in different pH conditions[期刊论文]，Chemical Engineering Journal，2023-01-15
  • 6. DOI Wang, Jiayi;Xu, Haoxiang;Che, Chunxia;Zhu, Jiqin;Cheng, Daojian
    Rational Design of PdAg Catalysts for Acetylene Selective Hydrogenation via Structural Descriptor-based Screening Strategy[期刊论文]，ACS Catalysis，2023-01-06
  • 7. DOI Zhang, Huimin;Guo, Xiaoyan;Liu, Wenhao;Wu, Dengfeng;Cao, Dong;Cheng, Daojian
    Regulating surface composition of platinum-copper nanotubes for enhanced hydrogen evolution reaction in all pH values[期刊论文]，Journal of Colloid and Interface Science，2023-01-01
  • 8. DOI Cao, Dong;Shao, Jie;Cui, Yahui;Zhang, Lipeng;Cheng, Daojian
    Interfacial Engineering of Copper–Nickel Selenide Nanodendrites for Enhanced Overall Water Splitting in Alkali Condition[期刊论文]，Small，2023-01-01
  • 9. DOI Wang, Xuning;Xu, Haoxiang;Luo, Yibin;Cheng, Daojian
    High Selective Direct Synthesis of H2O2 over Pd-1@gamma-Al2O3 Single-Atom Catalyst[期刊论文]，CHEMCATCHEM，2022-11-08
  • 10. DOI Deng, Zhuoran;Zhao, Liqiang;Cheng, Daojian
    A high-throughput catalyst synthesis system for Ag-based catalysts[期刊论文]，Review of Scientific Instruments，2022-11-01
  • 11. DOI Xu, Xiaopei;Peng, Zhipeng;Xu, Haoxiang;Cheng, Daojian
    Computational screening of nonmetal dopants to active MoS2 basal-plane for hydrogen evolution reaction via structural descriptor[期刊论文]，Journal of Catalysis，2022-10-31
  • 12. DOI 曹东,许昊翔,Hongliang Li,Chen Feng,Jie Zeng,程道建
    Volcano-type relationship between oxidation states and catalytic activity of single-atom catalysts towards hydrogen evolution[期刊论文]，Nature Communications，2022-10-04
  • 13. DOI Yan, Jingjing;Xu, Haoxiang;Chang, Le;Lin, Aijun;Cheng, Daojian
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single-atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 14. DOI 燕晶晶,许昊翔,常乐,林爱军,程道建
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 15. DOI Cheng, Feipeng;Cheng, Jihao;Nan, Yang;Xie, Yuan;Yang, Tongqian;Cheng, Daojian;Zhu, Jiqin;Xu, Haoxiang
    Enhancing oxidative hydration of ethylene towards ethylene glycol over metal-modified titanosilicate catalysts[期刊论文]，Applied Catalysis A: General，2022-08-05
  • 16. DOI Wen, Qi-Xing;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Design of CuCs-doped Ag-based catalyst for ethylene epoxidation[期刊论文]，Chinese Journal of Chemical Physics，2022-08-01
  • 17. DOI 张眉佳,许昊翔,罗一斌,朱吉钦,程道建
    Enhancing the catalytic performance of PdAu catalysts by W induced strong interaction for the direct synthesis of H2O2[期刊论文]，Catalysis Science & Technology，2022-07-26
  • 18. DOI Deng, Zhuoran;Zhou, Yingcheng;Zhao, Liqiang;Cheng, Daojian
    Structures and structural evolution of M-N (M = Pt, Ag, Au, N=2-20) from combined revised particle swarm optimization and density function theory[期刊论文]，MOLECULAR SIMULATION，2022-07-03
  • 19. DOI Zhang, Huimin;Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Carbon-based material-supported single-atom catalysts for energy conversion[期刊论文]，ISCIENCE，2022-06-17
  • 20. DOI 陈志强;车春霞;吴登峰;温翯;韩伟;张峰;许昊翔;程道建
    乙炔选择性加氢催化剂研究进展[期刊论文]，化工进展，2022-03-17
  • 21. DOI Liu, Ning;Cao, Dong;Liu, Wenhao;Zhang, Huimin;Zhu, Yinhai;Chang, Le;Wu, Dengfeng;Cheng, Daojian
    Constructing La-doped ultrathin Co-based nanostructured electrocatalysts for high-performance water oxidation process[期刊论文]，International Journal of Hydrogen Energy，2022-01-01
  • 22. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Branch-leaf-shaped CuNi@NiFeCu nanodendrites as highly efficient electrocatalysts for overall water splitting[期刊论文]，Applied Catalysis B-Environmental，2021-12-05
  • 23. DOI Zhang, Meijia;Luo, Yibin;Wu, Dengfeng;Li, Qian;Xu, Haoxiang;Cheng, Daojian
    Promoter role of tungsten in W-Pd/Al2O3 catalyst for direct synthesis of H2O2: Modification of Pd/PdO ratio[期刊论文]，APPLIED CATALYSIS A-GENERAL，2021-11-25
  • 24. DOI 孙晋冬;展学成;吴登峰;谢元;马好文;许昊翔;程道建
    碳四炔烃选择性加氢催化剂研究进展[期刊论文]，石油学报(石油加工)，2021-10-15
  • 25. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Construction of Dual-Site Atomically Dispersed Electrocatalysts with Ru-C-5 Single Atoms and Ru-O-4 Nanoclusters for Accelerated Alkali Hydrogen Evolution[期刊论文]，Small，2021-08-01
  • 26. DOI Cao, Dong;Wang, Jiayi;Zhang, Huimin;Xu, Haoxiang;Cheng, Daojian
    Growth of IrCu nanoislands with rich IrCu/Ir interfaces enables highly efficient overall water splitting in non-acidic electrolytes[期刊论文]，Chemical Engineering Journal，2021-07-15
  • 27. DOI Zhu, Yinhai;Cao, Dong;Liu, Ning;Cheng, Daojian
    One-step synthesis of atomic Ru doped ultra-thin Co(OH)(2) nanosheets for oxygen evolution reaction in different pH values[期刊论文]，International Journal of Hydrogen Energy，2021-06-28
  • 28. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Metal Dopants in Enhancing the Selectivity of Ag-Catalyzed Ethylene Epoxidation: Optimizing Oxophilicity of Reaction Site via Cocatalytic Mechanism[期刊论文]，ACS Catalysis，2021-03-19
  • 29. DOI 吴建国;吴登峰;程道建
    丙烷脱氢制丙烯用单原子催化剂研究进展[期刊论文]，化工进展，2021-03-16
  • 30. DOI Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Review on Synthesis and Catalytic Coupling Mechanism of Highly Active Electrocatalysts for Water Splitting[期刊论文]，Energy Technology，2021-02-01
  • 31. DOI Ma, Haowen;Xu, Xiaopei;Xu, Haoxiang;Feng, Huixia;Xie, Yuan;Cheng, Daojian
    Understanding composition-dependent catalytic performance of PdAg for the hydrogenation of 1,3-butadiene to 1-butene[期刊论文]，CATALYSIS COMMUNICATIONS，2021-01-15
  • 32. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文]，Advances in Physics-X，2021-01-01
  • 33. DOI Huang, Xingkai;Xu, Haoxiang;Cao, Dong;Cheng, Daojian
    Interface construction of P-Substituted MoS2 as efficient and robust electrocatalyst for alkaline hydrogen evolution reaction[期刊论文]，Nano Energy，2020-12-01
  • 34. DOI Yang, Liu,许昊翔,Liu, Huibing,曾晓飞,程道建,黄燕,Zheng, Lirong,Cao, Rui,曹达鹏
    Oxygen-Reconstituted Active Species of Single-Atom Cu Catalysts for Oxygen Reduction Reaction[期刊论文]，Research，2020-10-05
  • 35. DOI Xu, Xiaopei,许昊翔,程道建
    Identification of the Anti-triangular Etched MoS2 with Comparative Activity with Commercial Pt for Hydrogen Evolution Reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-10-04
  • 36. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Growth of Highly Active Amorphous RuCu Nanosheets on Cu Nanotubes for the Hydrogen Evolution Reaction in Wide pH Values[期刊论文]，Small，2020-09-01
  • 37. DOI 许昊翔,程道建
    First-principles-aided Thermodynamic Modeling of Transition-metal Heterogeneous Catalysts: A review.[期刊论文]，Green Energy & Environment，2020-07-14
  • 38. DOI Xu, Haoxiang;Cheng, Daojian
    First-principles-aided thermodynamic modeling of transition-metal heterogeneous catalysts: A review[期刊论文]，GREEN ENERGY & ENVIRONMENT，2020-07-01
  • 39. DOI Che, Chunxia;Xu, Haoxiang;Wen, He;Gou, Galian;Cheng, Daojian
    Theoretical Study on the Structural, Thermal and Phase Stability of Pt-Cu Alloy Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2020-05-01
  • 40. DOI Zhang, Wei;Zhu, Jiqin;Cheng, Daojian;Zeng, Xiao Cheng
    PtCoNi Alloy Nanoclusters for Synergistic Catalytic Oxygen Reduction Reaction[期刊论文]，ACS APPLIED NANO MATERIALS，2020-03-01
  • 41. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Construction of Defect-Rich RhCu Nanotubes with Highly Active Rh3Cu1 Alloy Phase for Overall Water Splitting in All pH Values[期刊论文]，ADVANCED ENERGY MATERIALS，2020-03-01
  • 42. DOI Wu, Dengfeng;Zhang, Wei;Lin, Aijun;Cheng, Daojian
    Low Pt-Content Ternary PtNiCu Nanoparticles with Hollow Interiors and Accessible Surfaces as Enhanced Multifunctional Electrocatalysts[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2020-02-26
  • 43. DOI Wu, Dengfeng;Yang, Yang;Dai, Changqing;Cheng, Daojian
    Enhanced oxygen reduction activity of PtCu nanoparticles by morphology tuning and transition-metal doping[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-02-07
  • 44. DOI Huang, Xingkai;Xu, Xiaopei;Luan, Xiaoxu;Cheng, Daojian
    CoP nanowires coupled with CoMoP nanosheets as a highly efficient cooperative catalyst for hydrogen evolution reaction[期刊论文]，NANO ENERGY，2020-02-01
  • 45. DOI Zhou, Yingcheng;Zhao, Zheng;Cheng, Daojian
    Cluster structure prediction via revised particle-swarm optimization algorithm[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2020-02-01
  • 46. DOI Li, Lin-Xin;Xie, Zhi-Hui;Fernandez, Carlos;Wu, Liang;Cheng, Daojian;Jiang, Xiao-Hui;Zhong, Chuan-Jian
    Development of a thiophene derivative modified LDH coating for Mg alloy corrosion protection[期刊论文]，ELECTROCHIMICA ACTA，2020-01-10
  • 47. DOI Zhang, Junmeng;Xu, Xiaopei;Yang, Liu;Cheng, Daojian;Cao, Dapeng
    Single-Atom Ru Doping Induced Phase Transition of MoS2 and S Vacancy for Hydrogen Evolution Reaction[期刊论文]，SMALL METHODS，2019-12-11
  • 48. DOI Zhao, Zheng,许昊翔,Feng, Zongyu,Zhang, Yongqi,Cui, Meisheng,曹达鹏,程道建
    Design of High-Performance Co-Based Alloy Nanocatalysts for the Oxygen Reduction Reaction[期刊论文]，Chemistry - A European Journal，2019-12-03
  • 49. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Chlorine in Selectivity Enhancement of Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-11-27
  • 50. DOI Xu, Xiaopei;Xu, Haoxiang;Cheng, Daojian
    Design of high-performance MoS2 edge supported single-metal atom bifunctional catalysts for overall water splitting via a simple equation[期刊论文]，NANOSCALE，2019-11-14
  • 51. DOI Wu, Dengfeng;Cheng, Daojian
    Structure-controlled synthesis of one-dimensional PdCu nanoscatalysts via a seed-mediated approach for oxygen reduction reaction[期刊论文]，APPLIED SURFACE SCIENCE，2019-11-01
  • 52. DOI Huang, Xiaoyu;Yang, Yang;Cheng, Daojian
    Hydrogen generation from formic acid decomposition on Pd-Cu nanoalloys[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-09-13
  • 53. DOI Zhang, Wei;Deibert, David L.;Cheng, Daojian;Zeng, Xiao Cheng
    Magnetism in bimetallic PtxNiN-x clusters via cross-atomic coupling[期刊论文]，JOURNAL OF MATERIALS CHEMISTRY C，2019-08-14
  • 54. DOI Ma, Haowen;Yang, Yang;Feng, Huixia;Cheng, Daojian
    DFT Study of Pyrolysis Gasoline Hydrogenation on Pd(100), Pd(110) and Pd(111) Surfaces[期刊论文]，CATALYSIS LETTERS，2019-08-01
  • 55. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Fortunelli, Alessandro;Cheng, Daojian
    Selectivity-Driven Design of the Ag-Cu Alloys for the Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-07-24
  • 56. DOI Cao, Dong;Cheng, Daojian
    One-pot synthesis of copper-nickel sulfide nanowires for overall water splitting in alkaline media[期刊论文]，CHEMICAL COMMUNICATIONS，2019-07-18
  • 57. DOI Huang, Xingkai;Xu, Xiaopei;Li, Chao;Wu, Dengfeng;Cheng, Daojian;Cao, Dapeng
    Vertical CoP Nanoarray Wrapped by N,P-Doped Carbon for Hydrogen Evolution Reaction in Both Acidic and Alkaline Conditions[期刊论文]，ADVANCED ENERGY MATERIALS，2019-06-01
  • 58. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Cheng, Daojian
    The synergistic effect between crystal planes and promoters on Ag-catalyzed ethylene epoxidation[期刊论文]，APPLIED SURFACE SCIENCE，2019-05-15
  • 59. DOI Yang, Liu;Xu, Haoxiang;Liu, Huibing;Cheng, Daojian;Cao, Dapeng
    Active Site Identification and Evaluation Criteria of In Situ Grown CoTe and NiTe Nanoarrays for Hydrogen Evolution and Oxygen Evolution Reactions[期刊论文]，SMALL METHODS，2019-05-10
  • 60. DOI Yang, Chenxi;Wang, Guoqing;Liang, Aimin;Yue, Yi;Peng, Hui;Cheng, Daojian
    Understanding the role of Au in the selective hydrogenation of acetylene on trimetallic PdAgAu catalytic surface[期刊论文]，CATALYSIS COMMUNICATIONS，2019-05-05
  • 61. DOI Li, Pengcheng;Wu, Dengfeng;Dai, Changqing;Huang, Xingkai;Li, Chao;Yin, Zhen;Zhou, Song;Lv, Zhengang;Cheng, Daojian;Zhu, Jiqin;Xu, Jian;Liu, Xi
    Controlled Synthesis of Copper-Doped Molybdenum Carbide Catalyst with Enhanced Activity and Stability for Hydrogen Evolution Reaction[期刊论文]，CATALYSIS LETTERS，2019-05-01
  • 62. DOI Elouarzaki Kamal,Wang Yian,Kannan Vishvak,许昊翔,程道建,Lee Jong-Min,Fisher Adrian C.
    Hydrogenase-Like Electrocatalytic Activation and Inactivation Mechanism by Three-Dimensional Binderless Molecular Catalyst[期刊论文]，ACS Applied Energy Materials，2019-04-09
  • 63. DOI Xu, Haoxiang;Cheng, Daojian
    Rational design of transition metal nanocatalyst by structure descriptor[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2019-03-31
  • 64. DOI Yang, Mengjie;Wu, Dengfeng;Cheng, Daojian
    Biomass-derived porous carbon supported Co-CoO yolk-shell nanoparticles as enhanced multifunctional electrocatalysts[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-03-08
  • 65. DOI Zhao, Zheng;Kong, Kewei;Wang, Shixian;Zhou, Yingcheng;Cheng, Daojian;Wang, Wenchuan;Zeng, Xiao Cheng;Li, Hui
    Understanding Hygroscopic Nucleation of Sulfate Aerosols: Combination of Molecular Dynamics Simulation with Classical Nucleation Theory[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY LETTERS，2019-03-07
  • 66. DOI Lv, Yanlong,朱琳,许昊翔,Yang, Liu,刘志平,程道建,Cao, Xiaohua,Yun Jimmy,曹达鹏
    Core/shell Template-derived Co, N-doped Carbon Bifunctional Electrocatalysts for Rechargeable Zn-air Battery[期刊论文]，Engineered Science，2019-02-28
  • 67. DOI Zhao, Zheng;Xu, Haoxiang;Gao, Yi;Cheng, Daojian
    Universal description of heating-induced reshaping preference of core-shell bimetallic nanoparticles[期刊论文]，NANOSCALE，2019-01-21
  • 68. DOI Yang, Yang,Zhao, Zheng,程道建,朱吉钦
    Effect of Size and Composition on the Structural Stability of Pt–Ni Nanoalloys[期刊论文]，Journal of Cluster Science，2019-01-14
  • 69. DOI Nan, Yang;Wang, Yinuo;Cao, Dong;Yang, Yang;Cheng, Daojian
    Adsorption and dissociation of borohydride on different Ir-Ni alloy surfaces[期刊论文]，Appl Surf Sci，2019-01-01
  • 70. DOI Yang, Yang,许昊翔,曹达鹏,曾晓成,程道建
    Hydrogen Production via Efficient Formic Acid Decomposition: Engineering the Surface Structure of Pd-Based Alloy Catalysts by Design[期刊论文]，ACS Catalysis，2018-12-07
  • 71. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Zhu, Jiqin;Cheng, Daojian
    Facet-dependent diffusion of atomic oxygen on Ag surfaces[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2018-12-01
  • 72. DOI Chang, Le;Cheng, Daojian;Sementa, Luca;Fortunelli, Alessandro
    Hydrogen evolution reaction (HER) on Au@Ag ultrananoclusters as electro-catalysts[期刊论文]，NANOSCALE，2018-10-07
  • 73. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi;Zeng, Xiao Cheng
    Assessment of Catalytic Activities of Gold Nanoclusters with Simple Structure Descriptors[期刊论文]，ACS CATALYSIS，2018-10-01
  • 74. DOI Yang, Yang;Dai, Changqing;Wu, Dengfeng;Liu, Zhiping;Cheng, Daojian
    The Size Effect of PdCu Bimetallic Nanoparticles on Oxygen Reduction Reaction Activity[期刊论文]，CHEMELECTROCHEM，2018-09-12
  • 75. DOI Lian, Xiaojun;Niu, Mang;Huang, Yan;Cheng, Daojian
    MoS2-CdS heterojunction with enhanced photocatalytic activity: A first principles study[期刊论文]，JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS，2018-09-01
  • 76. DOI Huang, Yichao;Hu, Jun;Xu, Haoxiang;Bian, Wei;Ge, Jingxuan;Zang, Dejin;Cheng, Daojian;Lv, Yaokang;Zhang, Cheng;Gu, Jing;Wei, Yongge
    Fine Tuning Electronic Structure of Catalysts through Atomic Engineering for Enhanced Hydrogen Evolution[期刊论文]，ADVANCED ENERGY MATERIALS，2018-08-27
  • 77. DOI Miao, Xue-Pei;Cheng, Dao-Jian;Dai, Ya-Dong;Meng, Yan;Li, Xiao-Yu
    Origin of Modulus Improvement for Epoxide-terminated Hyperbranched Poly(ether sulphone)/DGEBA/TETA Systems[期刊论文]，CHINESE JOURNAL OF POLYMER SCIENCE，2018-08-01
  • 78. DOI Chang, Le;Baseggio, Oscar;Sernenta, Luca;Cheng, Daojian;Fronzoni, Giovanna;Toffoli, Daniele;Apra, Edoardo;Stener, Mauro;Fortunelli, Alessandro
    Individual Component Map of Rotatory Strength and Rotatory Strength Density Plots As Analysis Tools of Circular Dichroism Spectra of Complex Systems[期刊论文]，JOURNAL OF CHEMICAL THEORY AND COMPUTATION，2018-07-01
  • 79. DOI Elouarzaki, Kamal;Cheng, Daojian;Fisher, Adrian C.;Lee, Jong-Min
    Coupling orientation and mediation strategies for efficient electron transfer in hybrid biofuel cells[期刊论文]，NATURE ENERGY，2018-07-01
  • 80. DOI Wang, Zegao;Li, Qiang;Xu, Haoxiang;Dahl-Petersen, Christian;Yang, Qian;Cheng, Daojian;Cao, Dapeng;Besenbacher, Flemming;Lauritsen, Jeppe V.;Helveg, Stig;Dong, Mingdong
    Controllable etching of MoS2 basal planes for enhanced hydrogen evolution through the formation of active edge sites[期刊论文]，NANO ENERGY，2018-07-01
  • 81. DOI Yang, Liu;Cheng, Daojian;Zeng, Xiaofei;Wan, Xin;Shui, Jianglan;Xiang, Zhonghua;Cao, Dapeng
    Unveiling the high-activity origin of single-atom iron catalysts for oxygen reduction reaction[期刊论文]，PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA，2018-06-26
  • 82. DOI 杨洋,Yu, Haiyan,Cai, Yushun,Ferrando, Riccardo,程道建
    Origin of enhanced stability and oxygen adsorption capacity of mediumsized Pt–Ni nanoclusters[期刊论文]，Journal of Physics: Condensed Matter，2018-06-22
  • 83. DOI Yu, Haiyan,Yang, Liu,程道建,曹达鹏
    Zeolitic-imidazolate Framework (ZIF)@ZnCo-ZIF Core-shell Template Derived Co, N-doped Carbon Catalysts for Oxygen Reduction Reaction[期刊论文]，Engineered Science，2018-06-02
  • 84. DOI 吴登峰,Zhang, Xin,朱吉钦,程道建
    Concerted Catalysis on Tanghulu-like Cu@Zeolitic Imidazolate Framework-8 (ZIF-8) Nanowires with Tuning Catalytic Performances for 4-nitrophenol Reduction[期刊论文]，Engineered Science，2018-05-21
  • 85. DOI Huang, Yan;Wu, Dengfeng;Cao, Dapeng;Cheng, Daojian
    Facile preparation of biomass-derived bifunctional electrocatalysts for oxygen reduction and evolution reactions[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2018-05-03
  • 86. DOI Xu, Haoxiang;Cheng, Daojian;Cao, Dapeng;Zeng, Xiao Cheng
    A universal principle for a rational design of single-atom electrocatalysts[期刊论文]，NATURE CATALYSIS，2018-05-01
  • 87. DOI Li, Zhenhao;Zhu, Lin;Chen, Jian-Feng;Cheng, Daojian
    Enhanced Ethylene Oxide Selectivity by Cu and Re Dual-Promoted Ag Catalysts[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2018-03-28
  • 88. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian
    Enhanced photochemical performance of hexagonal WO3 by metal-assisted S-O coupling for solar-driven water splitting[期刊论文]，SCIENCE CHINA-MATERIALS，2018-01-01
  • 89. DOI Xu, Haoxiang;Xu, Cong-Qiao;Cheng, Daojian;Li, Jun
    Identification of activity trends for CO oxidation on supported transition-metal single-atom catalysts[期刊论文]，CATALYSIS SCIENCE & TECHNOLOGY，2017-12-21
  • 90. DOI Ren, Dongmei;Cheng, Gang;Li, Jianwei;Li, Jinbing;Dai, Wujun;Sun, XinXin;Cheng, Daojian
    Effect of Rhenium Loading Sequence on Selectivity of Ag-Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-12-01
  • 91. DOI Huang, Xingkai;Wu, Dengfeng;Cheng, Daojian
    Porous Co2P nanowires as high efficient bifunctional catalysts for 4-nitrophenol reduction and sodium borohydride hydrolysis[期刊论文]，JOURNAL OF COLLOID AND INTERFACE SCIENCE，2017-12-01
  • 92. DOI Ren, Dongmei;Xu, Haoxiang;Li, Jianwei;Li, Jinhing;Cheng, Daojian
    Origin of enhanced ethylene oxide selectivity by Cs-promoted silver catalyst[期刊论文]，MOLECULAR CATALYSIS，2017-11-01
  • 93. DOI Wei, Yongsheng;Huang, Xingkai;Wang, Junyan;Yu, Haiyan;Zhao, Xinsheng;Cheng, Daojian
    Synthesis of bifunctional non-noble monolithic catalyst Co-W-P/carbon cloth for sodium borohydride hydrolysis and reduction of 4-nitrophenol[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2017-10-12
  • 94. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 95. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 96. DOI Yan, Bailu;Zhao, Zheng;Zhou, Yingcheng;Yuan, Wenyan;Li, Jian;Wu, Jun;Cheng, Daojian
    A particle swarm optimization algorithm with random learning mechanism and Levy flight for optimization of atomic clusters[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2017-10-01
  • 97. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 98. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 99. DOI Yang, Yang;Dai, Changqing;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    A full understanding of oxygen reduction reaction mechanism on Au(111) surface[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2017-09-13
  • 100. DOI Shan, Aixian;Chen, Chinping;Zhang, Wei;Cheng, Daojian;Shen, Xi;Yu, Richeng;Wang, Rongming
    Giant enhancement and anomalous temperature dependence of magnetism in monodispersed NiPt2 nanoparticles[期刊论文]，NANO RESEARCH，2017-09-01
  • 101. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 102. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 103. DOI Zhang, Xing;Wu, Dengfeng;Cheng, Daojian
    Component-dependent electrocatalytic activity of PdCu bimetallic nanoparticles for hydrogen evolution reaction[期刊论文]，ELECTROCHIMICA ACTA，2017-08-20
  • 104. DOI Zhao, Zheng;Wang, Fang-Hui;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Phase stability and segregation behavior of nickel-based nanoalloys based on theory and simulation[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2017-06-25
  • 105. DOI Wu, Dengfeng;Zhang, Wei;Cheng, Daojian
    Facile Synthesis of Cu/NiCu Electrocatalysts Integrating Alloy, Core Shell, and One-Dimensional Structures for Efficient Methanol Oxidation Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2017-06-14
  • 106. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 107. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 108. DOI Zhang, Wei;Shan, Shiyao;Luo, Jin;Fisher, Adrian;Chen, Jian-Feng;Zhong, Chuan-Jian;Zhu, Jiqin;Chen, Daojian
    Origin of Enhanced Activities for CO Oxidation and O-2 Reaction over Composition-Optimized Pd50Cu50 Nanoalloy Catalysts[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2017-05-25
  • 109. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin;Cheng, Daojian
    Mechanistic insight into the facet-dependent selectivity of ethylene epoxidation on Ag nanocatalysts[期刊论文]，APPLIED CATALYSIS A: GENERAL，2017-05-25
  • 110. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin
    Ni (111)-supported graphene as a potential catalyst for high-efficient CO oxidation[期刊论文]，CARBON，2017-05-01
  • 111. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi
    Design of High-Performance Pd-Based Alloy Nanocatalysts for Direct Synthesis of H2O2[期刊论文]，ACS CATALYSIS，2017-03-01
  • 112. DOI Yu, Haiyan;Cao, Dapeng;Fisher, Adrian;Johnston, Roy L.;Cheng, Daojian
    Size effect on the adsorption and dissociation of CO2 on Co nanoclusters[期刊论文]，APPLIED SURFACE SCIENCE，2017-02-28
  • 113. DOI Lian, Xiaojun;Zhao, Zheng;Cheng, Daojian
    Recent progress on triphenylamine materials: synthesis, properties, and applications[期刊论文]，MOLECULAR CRYSTALS AND LIQUID CRYSTALS，2017-01-01
  • 114. DOI Wu, Dengfeng;Xu, Haoxiang;Cao, Dapeng;Fisher, Adrian;Gao, Yi;Cheng, Daojian
    PdCu alloy nanoparticle-decorated copper nanotubes as enhanced electrocatalysts: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-12-09
  • 115. DOI Dai, Changqing;Yang, Yang;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Interaction of CO2 with metal cluster-functionalized ionic liquids[期刊论文]，JOURNAL OF CO2 UTILIZATION，2016-12-01
  • 116. DOI Wei, Chengcheng;Zhao, Zheng;Fisher, Adrian;Zhu, Jiqin;Cheng, Daojian
    Theoretical Study on the Structures and Thermal Properties of Ag-Pt-Ni Trimetallic Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-11-01
  • 117. DOI Cheng, Daojian;Wu, Dengfeng;Xu, Haoxiang;Fisher, Adrian
    Composition-controlled Synthesis of PtCuNPs Shells on Copper Nanowires as Electrocatalysts[期刊论文]，CHEMISTRYSELECT，2016-09-16
  • 118. DOI Yu, Haiyan;Fisher, Adrian;Cheng, Daojian;Cao, Dapeng
    Cu,N-codoped Hierarchical Porous Carbons as Electrocatalysts for Oxygen Reduction Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2016-08-24
  • 119. DOI Yang, Yang;Dai, Changqing;Shen, Yanchun;Fisher, Adrian;Cheng, Daojian
    Design of binary and ternary platinum shelled electrocatalysts with inexpensive metals for the oxygen reduction reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2016-08-10
  • 120. DOI Liu, Xinyue;Dai, Changqing;Wu, Dengfeng;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Facile Synthesis of PdAgCo Trimetallic Nanoparticles for Formic Acid Electrochemical Oxidation[期刊论文]，CHEMISTRY LETTERS，2016-07-05
  • 121. DOI 程道建
    双金属纳米电催化:理论和实验研究[会议论文]，中国化学会第30届学术年会摘要集-第二十九分会：电化学材料，2016-07-01
  • 122. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    A density functional theory study of sulfur adsorption on Ag-Au nanoalloys[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2016-06-01
  • 123. DOI 程道建
    双金属纳米催化:理论和实验研究[会议论文]，第七届全国物理无机化学学术会议论文集，2016-05-06
  • 124. DOI Zhao, Zheng;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Magnetic Properties of Pt-Based Nanoalloys: A Critical Review[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-05-01
  • 125. DOI Zhao, Zheng;Fisher, Adrian;Cheng, Daojian
    Phase diagram and segregation of Ag-Co nanoalloys: insights from theory and simulation[期刊论文]，NANOTECHNOLOGY，2016-03-18
  • 126. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Huan, Haifeng;Cao, Dapeng
    Enhanced near-infrared shielding ability of (Li, K)-codoped WO3 for smart windows: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-02-09
  • 127. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Highly sensitive and selective colorimetric detection of sulphide using Ag-Au nanoalloys: a DFT study[期刊论文]，RSC ADVANCES，2016-01-01
  • 128. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文]，MOLECULAR SIMULATION，2016-01-01
  • 129. DOI Chang, Le;Liu, Zhiping;Cheng, Daojian
    Optical properties of Ag-Au nanoclusters for sulphide sensing from TDDFT calculations[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2015-12-25
  • 130. DOI Zhang, Wei;Cui, Rong;Wu, Hao;Zhu, Jiqin;Cheng, Daojian
    CO oxidation mechanism on a MgO(100) supported PtxAu3-x clusters[期刊论文]，APPLIED SURFACE SCIENCE，2015-11-30
  • 131. DOI Zhang, Wei;Sumer, Aslihan;Jellinek, Julius;Cheng, Daojian
    Morphology Tailoring of Pt Nanocatalysts for the Oxygen Reduction Reaction: The Paradigm of Pt-13[期刊论文]，CHEMNANOMAT，2015-11-01
  • 132. DOI Wu, Dengfeng;Cheng, Daojian
    Core/shell AgNi/PtAgNi nanoparticles as methanol-tolerant oxygen reduction electrocatalysts[期刊论文]，ELECTROCHIMICA ACTA，2015-10-20
  • 133. DOI wang,qian,fang,yu,孟洪,毋伟,初广文,邹海魁,程道建,陈建峰
    Enhanced simulated sunlight induced photocatalytic activity by pomegranate-like S doped SnO2@TiO2 spheres[期刊论文]，Colloids and Surfaces A: Physicochemical and Engineering Aspects，2015-10-05
  • 134. DOI Niu, Mang;Tan, Huaqiao;Cheng, Daojian;Sun, Zaicheng;Cao, Dapeng
    Bandgap engineering of Magnei phase TinO2n-1: Electron-hole self-compensation[期刊论文]，JOURNAL OF CHEMICAL PHYSICS，2015-08-07
  • 135. DOI Wu, Dengfeng;Dai, Changqing;Li, Shaojie;Cheng, Daojian
    Shape-controlled Synthesis of PdCu Nanocrystals for Formic Acid Oxidation[期刊论文]，CHEMISTRY LETTERS，2015-08-05
  • 136. DOI Niu, Mang;Cui, Rong;Wu, Hao;Cheng, Daojian;Cao, Dapeng
    Enhancement Mechanism of the Conversion Effficiency of Dye-Sensitized Solar Sells Based on Nitrogen-, Fluorine-, and Iodine-Doped TiO2 Photoanodes[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-06-18
  • 137. DOI Yang, Yang;Zhao, Zheng;Cui, Rong;Wu, Hao;Cheng, Daojian
    Structures, Thermal Stability, and Chemical Activity of Crown-Jewel-Structured Pd-Pt Nanoalloys[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-05-21
  • 138. DOI Wang, Jian;Yuan, Wenyan;Cheng, Daojian
    Hybrid genetic-particle swarm algorithm: An efficient method for fast optimization of atomic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2015-05-01
  • 139. DOI Xu, Haoxiang;Cheng, Daojian
    Effect of the Passivating Ligands on the Geometric and Electronic Properties of Au-Pd Nanoalloys[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2015-05-01
  • 140. DOI Chen, Bing;Cheng, Daojian;Zhu, Jiqin
    Synthesis of PtCu nanowires in nonaqueous solvent with enhanced activity and stability for oxygen reduction reaction[期刊论文]，JOURNAL OF POWER SOURCES，2014-12-01
  • 141. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Cao, Dapeng
    Design of the Alkali-Metal-Doped WO3 as a Near-Infrared Shielding Material for Smart Window[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2014-11-19
  • 142. DOI Li, Shaojie;Cheng, Daojian;Qiu, Xiangguo;Cao, Dapeng
    Synthesis of Cu@Pd core-shell nanowires with enhanced activity and stability for formic acid oxidation[期刊论文]，ELECTROCHIMICA ACTA，2014-10-10
  • 143. DOI Chang, Le;Xu, Haoxiang;Cheng, Daojian
    Role of ligand type on the geometric and electronic properties of Ag-Au bimetallic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2014-10-01
  • 144. DOI Zhao, Zheng;Li, Mingjiang;Cheng, Daojian;Zhu, Jiqin
    Understanding the structural properties and thermal stabilities of Au-Pd-Pt trimetallic clustersle[期刊论文]，CHEMICAL PHYSICS，2014-09-30
  • 145. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Fluorite TiO2(111) Surface Phase for Enhanced Visible-Light Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-09-04
  • 146. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    SiH/TiO2 and GeH/TiO2 Heterojunctions: Promising TiO2-based Photocatalysts under Visible Light[期刊论文]，SCIENTIFIC REPORTS，2014-05-02
  • 147. DOI Cheng, Daojian;Xu, Haoxiang;Fortunelli, Alessandro
    Tuning the catalytic activity of Au-Pd nanoalloys in CO oxidation via composition[期刊论文]，JOURNAL OF CATALYSIS，2014-05-01
  • 148. DOI Fang, Yu;Cheng, Daojian;Wu, Wei
    Understanding electronic and optical properties of N-Sn codoped anatase TiO2[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-04-01
  • 149. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding the Mechanism of Photocatalysis Enhancements in the Graphene-like Semiconductor Sheet/TiO2 Composites[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-03-20
  • 150. DOI Cheng, Daojian;Zhang, Minming;Chen, Jianfeng;Yang, Chenxi;Zeng, Xiaofei;Cao, Dapeng
    Computer Screening of Dopants for the Development of New SnO2-Based Transparent Conducting Oxides[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-30
  • 151. DOI Yang, Yang;Cheng, Daojian
    Role of Composition and Geometric Relaxation in CO2 Binding to Cu-Ni Bimetallic Clusters[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-09
  • 152. DOI Zhang, Wei;Cheng, Daojian;Zhu, Jiqin
    Theoretical study of CO catalytic oxidation on free and defective graphene-supported Au-Pd bimetallic clusters[期刊论文]，RSC ADVANCES，2014-01-01
  • 153. DOI Cheng, Daojian;Qiu, Xiangguo;Yu, Haiyan
    Enhancing oxygen reduction reaction activity of Pt-shelled catalysts via subsurface alloying[期刊论文]，PHYSICAL CHEMISTRY CHEMICAL PHYSICS，2014-01-01
  • 154. DOI Tan, Huaqiao;Zhao, Zhao;Niu, Mang;Mao, Chengyu;Cao, Dapeng;Cheng, Daojian;Feng, Pingyun;Sun, Zaicheng
    A facile and versatile method for preparation of colored TiO2 with enhanced solar-driven photocatalytic activity[期刊论文]，NANOSCALE，2014-01-01
  • 155. DOI Li, Mingjiang;Li, Shaojie;Cheng, Daojian
    Influence of adsorbates on the segregation properties of Au-Pd bimetallic clusters[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-01-01
  • 156. DOI Li, Mingjiang;Cheng, Daojian
    Molecular Dynamics Simulation of the Melting Behavior of Crown-Jewel Structured Au-Pd Nanoalloys[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-09-12
  • 157. DOI Cheng, Daojian;Yuan, Shuai;Ferrando, Riccardo
    Structure, chemical ordering and thermal stability of Pt-Ni alloy nanoclusters[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2013-09-04
  • 158. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding Photoelectrochennical Properties of B-N Codoped Anatase TiO2 for Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-08-08
  • 159. DOI Cheng, Daojian;Negreiros, Fabio R.;Apra, Edoardo;Fortunelli, Alessandro
    Computational Approaches to the Chemical Conversion of Carbon Dioxide[期刊论文]，CHEMSUSCHEM，2013-06-01
  • 160. DOI Fang, Yu;Cheng, Daojian;Niu, Mang;Yi, Yongjun;Wu, Wei
    Tailoring the electronic and optical properties of rutile TiO2 by (Nb + Sb, C) codoping from DFT plus U calculations[期刊论文]，CHEMICAL PHYSICS LETTERS，2013-04-19
  • 161. DOI Cheng, Daojian;Cao, Dapeng;Wang, Wenchuan
    Hydrogen storage in porous materials and nanoalloys as catalysts for fuel cell application by using multiscale simulation and experimental methods[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2013-04-07
  • 162. DOI Cheng, Daojian;Jiang, Kun
    Structural stability and kinetics of small carbon clusters on a bimetallic Cu/Ni(111) surface: A first-principles study[期刊论文]，SURFACE SCIENCE，2013-03-01
  • 163. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Enhanced photoelectrochemical performance of anatase TiO2 by metal-assisted S-O coupling for water splitting[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2013-02-06
[+][-] 2028年
  • 1. DOI Zhang, Huimin;Liu, Wenhao;Li, Zhenhao;Qiao, Liang;Chi, Kebin;Guo, Xiaoyan;Cao, Dong;Cheng, Daojian
    Constructing CoP/Ni2P Heterostructure Confined Ru Sub-Nanoclusters for Enhanced Water Splitting in Wide pH Conditions[期刊论文]，Advanced Science，2024-09-18
  • 2. DOI Cao, Dong;Zhang, Zhirong;Cui, Yahui;Zhang, Runhao;Zhang, Lipeng;Zeng, Jie;Cheng, Daojian
    One-Step Approach for Constructing High-Density Single-Atom Catalysts toward Overall Water Splitting at Industrial Current Densities[期刊论文]，Angewandte Chemie-International Edition，2023-02-20
  • 3. DOI Sun, Jindong;Xu, Haoxiang;Ma, Haowen;Zhan, Xuecheng;Zhu, Jiqin;Cheng, Daojian
    Isoprene selective hydrogenation using AgCu-promoted Pd nanoalloys[期刊论文]，FARADAY DISCUSSIONS，2023-01-31
  • 4. DOI Liu, Tianpeng;Liu, Wenhao;Ma, Mengyao;Guo, Linke;Cui, Rong;Cheng, Daojian;Cao, Dong
    Constructing nickel vanadium phosphide nanoarrays with highly active heterointerfaces for water oxidation in alkali media[期刊论文]，ELECTROCHIMICA ACTA，2023-01-20
  • 5. DOI Cao, Dong;Huang, Xiaoyu;Zhang, Huimin;Liu, Wenhao;Cheng, Daojian
    Constructing porous RuCu nanotubes with highly efficient alloy phase for water splitting in different pH conditions[期刊论文]，Chemical Engineering Journal，2023-01-15
  • 6. DOI Wang, Jiayi;Xu, Haoxiang;Che, Chunxia;Zhu, Jiqin;Cheng, Daojian
    Rational Design of PdAg Catalysts for Acetylene Selective Hydrogenation via Structural Descriptor-based Screening Strategy[期刊论文]，ACS Catalysis，2023-01-06
  • 7. DOI Zhang, Huimin;Guo, Xiaoyan;Liu, Wenhao;Wu, Dengfeng;Cao, Dong;Cheng, Daojian
    Regulating surface composition of platinum-copper nanotubes for enhanced hydrogen evolution reaction in all pH values[期刊论文]，Journal of Colloid and Interface Science，2023-01-01
  • 8. DOI Cao, Dong;Shao, Jie;Cui, Yahui;Zhang, Lipeng;Cheng, Daojian
    Interfacial Engineering of Copper–Nickel Selenide Nanodendrites for Enhanced Overall Water Splitting in Alkali Condition[期刊论文]，Small，2023-01-01
  • 9. DOI Wang, Xuning;Xu, Haoxiang;Luo, Yibin;Cheng, Daojian
    High Selective Direct Synthesis of H2O2 over Pd-1@gamma-Al2O3 Single-Atom Catalyst[期刊论文]，CHEMCATCHEM，2022-11-08
  • 10. DOI Deng, Zhuoran;Zhao, Liqiang;Cheng, Daojian
    A high-throughput catalyst synthesis system for Ag-based catalysts[期刊论文]，Review of Scientific Instruments，2022-11-01
  • 11. DOI Xu, Xiaopei;Peng, Zhipeng;Xu, Haoxiang;Cheng, Daojian
    Computational screening of nonmetal dopants to active MoS2 basal-plane for hydrogen evolution reaction via structural descriptor[期刊论文]，Journal of Catalysis，2022-10-31
  • 12. DOI 曹东,许昊翔,Hongliang Li,Chen Feng,Jie Zeng,程道建
    Volcano-type relationship between oxidation states and catalytic activity of single-atom catalysts towards hydrogen evolution[期刊论文]，Nature Communications，2022-10-04
  • 13. DOI Yan, Jingjing;Xu, Haoxiang;Chang, Le;Lin, Aijun;Cheng, Daojian
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single-atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 14. DOI 燕晶晶,许昊翔,常乐,林爱军,程道建
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 15. DOI Cheng, Feipeng;Cheng, Jihao;Nan, Yang;Xie, Yuan;Yang, Tongqian;Cheng, Daojian;Zhu, Jiqin;Xu, Haoxiang
    Enhancing oxidative hydration of ethylene towards ethylene glycol over metal-modified titanosilicate catalysts[期刊论文]，Applied Catalysis A: General，2022-08-05
  • 16. DOI Wen, Qi-Xing;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Design of CuCs-doped Ag-based catalyst for ethylene epoxidation[期刊论文]，Chinese Journal of Chemical Physics，2022-08-01
  • 17. DOI 张眉佳,许昊翔,罗一斌,朱吉钦,程道建
    Enhancing the catalytic performance of PdAu catalysts by W induced strong interaction for the direct synthesis of H2O2[期刊论文]，Catalysis Science & Technology，2022-07-26
  • 18. DOI Deng, Zhuoran;Zhou, Yingcheng;Zhao, Liqiang;Cheng, Daojian
    Structures and structural evolution of M-N (M = Pt, Ag, Au, N=2-20) from combined revised particle swarm optimization and density function theory[期刊论文]，MOLECULAR SIMULATION，2022-07-03
  • 19. DOI Zhang, Huimin;Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Carbon-based material-supported single-atom catalysts for energy conversion[期刊论文]，ISCIENCE，2022-06-17
  • 20. DOI 陈志强;车春霞;吴登峰;温翯;韩伟;张峰;许昊翔;程道建
    乙炔选择性加氢催化剂研究进展[期刊论文]，化工进展，2022-03-17
  • 21. DOI Liu, Ning;Cao, Dong;Liu, Wenhao;Zhang, Huimin;Zhu, Yinhai;Chang, Le;Wu, Dengfeng;Cheng, Daojian
    Constructing La-doped ultrathin Co-based nanostructured electrocatalysts for high-performance water oxidation process[期刊论文]，International Journal of Hydrogen Energy，2022-01-01
  • 22. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Branch-leaf-shaped CuNi@NiFeCu nanodendrites as highly efficient electrocatalysts for overall water splitting[期刊论文]，Applied Catalysis B-Environmental，2021-12-05
  • 23. DOI Zhang, Meijia;Luo, Yibin;Wu, Dengfeng;Li, Qian;Xu, Haoxiang;Cheng, Daojian
    Promoter role of tungsten in W-Pd/Al2O3 catalyst for direct synthesis of H2O2: Modification of Pd/PdO ratio[期刊论文]，APPLIED CATALYSIS A-GENERAL，2021-11-25
  • 24. DOI 孙晋冬;展学成;吴登峰;谢元;马好文;许昊翔;程道建
    碳四炔烃选择性加氢催化剂研究进展[期刊论文]，石油学报(石油加工)，2021-10-15
  • 25. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Construction of Dual-Site Atomically Dispersed Electrocatalysts with Ru-C-5 Single Atoms and Ru-O-4 Nanoclusters for Accelerated Alkali Hydrogen Evolution[期刊论文]，Small，2021-08-01
  • 26. DOI Cao, Dong;Wang, Jiayi;Zhang, Huimin;Xu, Haoxiang;Cheng, Daojian
    Growth of IrCu nanoislands with rich IrCu/Ir interfaces enables highly efficient overall water splitting in non-acidic electrolytes[期刊论文]，Chemical Engineering Journal，2021-07-15
  • 27. DOI Zhu, Yinhai;Cao, Dong;Liu, Ning;Cheng, Daojian
    One-step synthesis of atomic Ru doped ultra-thin Co(OH)(2) nanosheets for oxygen evolution reaction in different pH values[期刊论文]，International Journal of Hydrogen Energy，2021-06-28
  • 28. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Metal Dopants in Enhancing the Selectivity of Ag-Catalyzed Ethylene Epoxidation: Optimizing Oxophilicity of Reaction Site via Cocatalytic Mechanism[期刊论文]，ACS Catalysis，2021-03-19
  • 29. DOI 吴建国;吴登峰;程道建
    丙烷脱氢制丙烯用单原子催化剂研究进展[期刊论文]，化工进展，2021-03-16
  • 30. DOI Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Review on Synthesis and Catalytic Coupling Mechanism of Highly Active Electrocatalysts for Water Splitting[期刊论文]，Energy Technology，2021-02-01
  • 31. DOI Ma, Haowen;Xu, Xiaopei;Xu, Haoxiang;Feng, Huixia;Xie, Yuan;Cheng, Daojian
    Understanding composition-dependent catalytic performance of PdAg for the hydrogenation of 1,3-butadiene to 1-butene[期刊论文]，CATALYSIS COMMUNICATIONS，2021-01-15
  • 32. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文]，Advances in Physics-X，2021-01-01
  • 33. DOI Huang, Xingkai;Xu, Haoxiang;Cao, Dong;Cheng, Daojian
    Interface construction of P-Substituted MoS2 as efficient and robust electrocatalyst for alkaline hydrogen evolution reaction[期刊论文]，Nano Energy，2020-12-01
  • 34. DOI Yang, Liu,许昊翔,Liu, Huibing,曾晓飞,程道建,黄燕,Zheng, Lirong,Cao, Rui,曹达鹏
    Oxygen-Reconstituted Active Species of Single-Atom Cu Catalysts for Oxygen Reduction Reaction[期刊论文]，Research，2020-10-05
  • 35. DOI Xu, Xiaopei,许昊翔,程道建
    Identification of the Anti-triangular Etched MoS2 with Comparative Activity with Commercial Pt for Hydrogen Evolution Reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-10-04
  • 36. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Growth of Highly Active Amorphous RuCu Nanosheets on Cu Nanotubes for the Hydrogen Evolution Reaction in Wide pH Values[期刊论文]，Small，2020-09-01
  • 37. DOI 许昊翔,程道建
    First-principles-aided Thermodynamic Modeling of Transition-metal Heterogeneous Catalysts: A review.[期刊论文]，Green Energy & Environment，2020-07-14
  • 38. DOI Xu, Haoxiang;Cheng, Daojian
    First-principles-aided thermodynamic modeling of transition-metal heterogeneous catalysts: A review[期刊论文]，GREEN ENERGY & ENVIRONMENT，2020-07-01
  • 39. DOI Che, Chunxia;Xu, Haoxiang;Wen, He;Gou, Galian;Cheng, Daojian
    Theoretical Study on the Structural, Thermal and Phase Stability of Pt-Cu Alloy Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2020-05-01
  • 40. DOI Zhang, Wei;Zhu, Jiqin;Cheng, Daojian;Zeng, Xiao Cheng
    PtCoNi Alloy Nanoclusters for Synergistic Catalytic Oxygen Reduction Reaction[期刊论文]，ACS APPLIED NANO MATERIALS，2020-03-01
  • 41. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Construction of Defect-Rich RhCu Nanotubes with Highly Active Rh3Cu1 Alloy Phase for Overall Water Splitting in All pH Values[期刊论文]，ADVANCED ENERGY MATERIALS，2020-03-01
  • 42. DOI Wu, Dengfeng;Zhang, Wei;Lin, Aijun;Cheng, Daojian
    Low Pt-Content Ternary PtNiCu Nanoparticles with Hollow Interiors and Accessible Surfaces as Enhanced Multifunctional Electrocatalysts[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2020-02-26
  • 43. DOI Wu, Dengfeng;Yang, Yang;Dai, Changqing;Cheng, Daojian
    Enhanced oxygen reduction activity of PtCu nanoparticles by morphology tuning and transition-metal doping[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-02-07
  • 44. DOI Huang, Xingkai;Xu, Xiaopei;Luan, Xiaoxu;Cheng, Daojian
    CoP nanowires coupled with CoMoP nanosheets as a highly efficient cooperative catalyst for hydrogen evolution reaction[期刊论文]，NANO ENERGY，2020-02-01
  • 45. DOI Zhou, Yingcheng;Zhao, Zheng;Cheng, Daojian
    Cluster structure prediction via revised particle-swarm optimization algorithm[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2020-02-01
  • 46. DOI Li, Lin-Xin;Xie, Zhi-Hui;Fernandez, Carlos;Wu, Liang;Cheng, Daojian;Jiang, Xiao-Hui;Zhong, Chuan-Jian
    Development of a thiophene derivative modified LDH coating for Mg alloy corrosion protection[期刊论文]，ELECTROCHIMICA ACTA，2020-01-10
  • 47. DOI Zhang, Junmeng;Xu, Xiaopei;Yang, Liu;Cheng, Daojian;Cao, Dapeng
    Single-Atom Ru Doping Induced Phase Transition of MoS2 and S Vacancy for Hydrogen Evolution Reaction[期刊论文]，SMALL METHODS，2019-12-11
  • 48. DOI Zhao, Zheng,许昊翔,Feng, Zongyu,Zhang, Yongqi,Cui, Meisheng,曹达鹏,程道建
    Design of High-Performance Co-Based Alloy Nanocatalysts for the Oxygen Reduction Reaction[期刊论文]，Chemistry - A European Journal，2019-12-03
  • 49. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Chlorine in Selectivity Enhancement of Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-11-27
  • 50. DOI Xu, Xiaopei;Xu, Haoxiang;Cheng, Daojian
    Design of high-performance MoS2 edge supported single-metal atom bifunctional catalysts for overall water splitting via a simple equation[期刊论文]，NANOSCALE，2019-11-14
  • 51. DOI Wu, Dengfeng;Cheng, Daojian
    Structure-controlled synthesis of one-dimensional PdCu nanoscatalysts via a seed-mediated approach for oxygen reduction reaction[期刊论文]，APPLIED SURFACE SCIENCE，2019-11-01
  • 52. DOI Huang, Xiaoyu;Yang, Yang;Cheng, Daojian
    Hydrogen generation from formic acid decomposition on Pd-Cu nanoalloys[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-09-13
  • 53. DOI Zhang, Wei;Deibert, David L.;Cheng, Daojian;Zeng, Xiao Cheng
    Magnetism in bimetallic PtxNiN-x clusters via cross-atomic coupling[期刊论文]，JOURNAL OF MATERIALS CHEMISTRY C，2019-08-14
  • 54. DOI Ma, Haowen;Yang, Yang;Feng, Huixia;Cheng, Daojian
    DFT Study of Pyrolysis Gasoline Hydrogenation on Pd(100), Pd(110) and Pd(111) Surfaces[期刊论文]，CATALYSIS LETTERS，2019-08-01
  • 55. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Fortunelli, Alessandro;Cheng, Daojian
    Selectivity-Driven Design of the Ag-Cu Alloys for the Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-07-24
  • 56. DOI Cao, Dong;Cheng, Daojian
    One-pot synthesis of copper-nickel sulfide nanowires for overall water splitting in alkaline media[期刊论文]，CHEMICAL COMMUNICATIONS，2019-07-18
  • 57. DOI Huang, Xingkai;Xu, Xiaopei;Li, Chao;Wu, Dengfeng;Cheng, Daojian;Cao, Dapeng
    Vertical CoP Nanoarray Wrapped by N,P-Doped Carbon for Hydrogen Evolution Reaction in Both Acidic and Alkaline Conditions[期刊论文]，ADVANCED ENERGY MATERIALS，2019-06-01
  • 58. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Cheng, Daojian
    The synergistic effect between crystal planes and promoters on Ag-catalyzed ethylene epoxidation[期刊论文]，APPLIED SURFACE SCIENCE，2019-05-15
  • 59. DOI Yang, Liu;Xu, Haoxiang;Liu, Huibing;Cheng, Daojian;Cao, Dapeng
    Active Site Identification and Evaluation Criteria of In Situ Grown CoTe and NiTe Nanoarrays for Hydrogen Evolution and Oxygen Evolution Reactions[期刊论文]，SMALL METHODS，2019-05-10
  • 60. DOI Yang, Chenxi;Wang, Guoqing;Liang, Aimin;Yue, Yi;Peng, Hui;Cheng, Daojian
    Understanding the role of Au in the selective hydrogenation of acetylene on trimetallic PdAgAu catalytic surface[期刊论文]，CATALYSIS COMMUNICATIONS，2019-05-05
  • 61. DOI Li, Pengcheng;Wu, Dengfeng;Dai, Changqing;Huang, Xingkai;Li, Chao;Yin, Zhen;Zhou, Song;Lv, Zhengang;Cheng, Daojian;Zhu, Jiqin;Xu, Jian;Liu, Xi
    Controlled Synthesis of Copper-Doped Molybdenum Carbide Catalyst with Enhanced Activity and Stability for Hydrogen Evolution Reaction[期刊论文]，CATALYSIS LETTERS，2019-05-01
  • 62. DOI Elouarzaki Kamal,Wang Yian,Kannan Vishvak,许昊翔,程道建,Lee Jong-Min,Fisher Adrian C.
    Hydrogenase-Like Electrocatalytic Activation and Inactivation Mechanism by Three-Dimensional Binderless Molecular Catalyst[期刊论文]，ACS Applied Energy Materials，2019-04-09
  • 63. DOI Xu, Haoxiang;Cheng, Daojian
    Rational design of transition metal nanocatalyst by structure descriptor[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2019-03-31
  • 64. DOI Yang, Mengjie;Wu, Dengfeng;Cheng, Daojian
    Biomass-derived porous carbon supported Co-CoO yolk-shell nanoparticles as enhanced multifunctional electrocatalysts[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-03-08
  • 65. DOI Zhao, Zheng;Kong, Kewei;Wang, Shixian;Zhou, Yingcheng;Cheng, Daojian;Wang, Wenchuan;Zeng, Xiao Cheng;Li, Hui
    Understanding Hygroscopic Nucleation of Sulfate Aerosols: Combination of Molecular Dynamics Simulation with Classical Nucleation Theory[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY LETTERS，2019-03-07
  • 66. DOI Lv, Yanlong,朱琳,许昊翔,Yang, Liu,刘志平,程道建,Cao, Xiaohua,Yun Jimmy,曹达鹏
    Core/shell Template-derived Co, N-doped Carbon Bifunctional Electrocatalysts for Rechargeable Zn-air Battery[期刊论文]，Engineered Science，2019-02-28
  • 67. DOI Zhao, Zheng;Xu, Haoxiang;Gao, Yi;Cheng, Daojian
    Universal description of heating-induced reshaping preference of core-shell bimetallic nanoparticles[期刊论文]，NANOSCALE，2019-01-21
  • 68. DOI Yang, Yang,Zhao, Zheng,程道建,朱吉钦
    Effect of Size and Composition on the Structural Stability of Pt–Ni Nanoalloys[期刊论文]，Journal of Cluster Science，2019-01-14
  • 69. DOI Nan, Yang;Wang, Yinuo;Cao, Dong;Yang, Yang;Cheng, Daojian
    Adsorption and dissociation of borohydride on different Ir-Ni alloy surfaces[期刊论文]，Appl Surf Sci，2019-01-01
  • 70. DOI Yang, Yang,许昊翔,曹达鹏,曾晓成,程道建
    Hydrogen Production via Efficient Formic Acid Decomposition: Engineering the Surface Structure of Pd-Based Alloy Catalysts by Design[期刊论文]，ACS Catalysis，2018-12-07
  • 71. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Zhu, Jiqin;Cheng, Daojian
    Facet-dependent diffusion of atomic oxygen on Ag surfaces[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2018-12-01
  • 72. DOI Chang, Le;Cheng, Daojian;Sementa, Luca;Fortunelli, Alessandro
    Hydrogen evolution reaction (HER) on Au@Ag ultrananoclusters as electro-catalysts[期刊论文]，NANOSCALE，2018-10-07
  • 73. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi;Zeng, Xiao Cheng
    Assessment of Catalytic Activities of Gold Nanoclusters with Simple Structure Descriptors[期刊论文]，ACS CATALYSIS，2018-10-01
  • 74. DOI Yang, Yang;Dai, Changqing;Wu, Dengfeng;Liu, Zhiping;Cheng, Daojian
    The Size Effect of PdCu Bimetallic Nanoparticles on Oxygen Reduction Reaction Activity[期刊论文]，CHEMELECTROCHEM，2018-09-12
  • 75. DOI Lian, Xiaojun;Niu, Mang;Huang, Yan;Cheng, Daojian
    MoS2-CdS heterojunction with enhanced photocatalytic activity: A first principles study[期刊论文]，JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS，2018-09-01
  • 76. DOI Huang, Yichao;Hu, Jun;Xu, Haoxiang;Bian, Wei;Ge, Jingxuan;Zang, Dejin;Cheng, Daojian;Lv, Yaokang;Zhang, Cheng;Gu, Jing;Wei, Yongge
    Fine Tuning Electronic Structure of Catalysts through Atomic Engineering for Enhanced Hydrogen Evolution[期刊论文]，ADVANCED ENERGY MATERIALS，2018-08-27
  • 77. DOI Miao, Xue-Pei;Cheng, Dao-Jian;Dai, Ya-Dong;Meng, Yan;Li, Xiao-Yu
    Origin of Modulus Improvement for Epoxide-terminated Hyperbranched Poly(ether sulphone)/DGEBA/TETA Systems[期刊论文]，CHINESE JOURNAL OF POLYMER SCIENCE，2018-08-01
  • 78. DOI Chang, Le;Baseggio, Oscar;Sernenta, Luca;Cheng, Daojian;Fronzoni, Giovanna;Toffoli, Daniele;Apra, Edoardo;Stener, Mauro;Fortunelli, Alessandro
    Individual Component Map of Rotatory Strength and Rotatory Strength Density Plots As Analysis Tools of Circular Dichroism Spectra of Complex Systems[期刊论文]，JOURNAL OF CHEMICAL THEORY AND COMPUTATION，2018-07-01
  • 79. DOI Elouarzaki, Kamal;Cheng, Daojian;Fisher, Adrian C.;Lee, Jong-Min
    Coupling orientation and mediation strategies for efficient electron transfer in hybrid biofuel cells[期刊论文]，NATURE ENERGY，2018-07-01
  • 80. DOI Wang, Zegao;Li, Qiang;Xu, Haoxiang;Dahl-Petersen, Christian;Yang, Qian;Cheng, Daojian;Cao, Dapeng;Besenbacher, Flemming;Lauritsen, Jeppe V.;Helveg, Stig;Dong, Mingdong
    Controllable etching of MoS2 basal planes for enhanced hydrogen evolution through the formation of active edge sites[期刊论文]，NANO ENERGY，2018-07-01
  • 81. DOI Yang, Liu;Cheng, Daojian;Zeng, Xiaofei;Wan, Xin;Shui, Jianglan;Xiang, Zhonghua;Cao, Dapeng
    Unveiling the high-activity origin of single-atom iron catalysts for oxygen reduction reaction[期刊论文]，PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA，2018-06-26
  • 82. DOI 杨洋,Yu, Haiyan,Cai, Yushun,Ferrando, Riccardo,程道建
    Origin of enhanced stability and oxygen adsorption capacity of mediumsized Pt–Ni nanoclusters[期刊论文]，Journal of Physics: Condensed Matter，2018-06-22
  • 83. DOI Yu, Haiyan,Yang, Liu,程道建,曹达鹏
    Zeolitic-imidazolate Framework (ZIF)@ZnCo-ZIF Core-shell Template Derived Co, N-doped Carbon Catalysts for Oxygen Reduction Reaction[期刊论文]，Engineered Science，2018-06-02
  • 84. DOI 吴登峰,Zhang, Xin,朱吉钦,程道建
    Concerted Catalysis on Tanghulu-like Cu@Zeolitic Imidazolate Framework-8 (ZIF-8) Nanowires with Tuning Catalytic Performances for 4-nitrophenol Reduction[期刊论文]，Engineered Science，2018-05-21
  • 85. DOI Huang, Yan;Wu, Dengfeng;Cao, Dapeng;Cheng, Daojian
    Facile preparation of biomass-derived bifunctional electrocatalysts for oxygen reduction and evolution reactions[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2018-05-03
  • 86. DOI Xu, Haoxiang;Cheng, Daojian;Cao, Dapeng;Zeng, Xiao Cheng
    A universal principle for a rational design of single-atom electrocatalysts[期刊论文]，NATURE CATALYSIS，2018-05-01
  • 87. DOI Li, Zhenhao;Zhu, Lin;Chen, Jian-Feng;Cheng, Daojian
    Enhanced Ethylene Oxide Selectivity by Cu and Re Dual-Promoted Ag Catalysts[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2018-03-28
  • 88. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian
    Enhanced photochemical performance of hexagonal WO3 by metal-assisted S-O coupling for solar-driven water splitting[期刊论文]，SCIENCE CHINA-MATERIALS，2018-01-01
  • 89. DOI Xu, Haoxiang;Xu, Cong-Qiao;Cheng, Daojian;Li, Jun
    Identification of activity trends for CO oxidation on supported transition-metal single-atom catalysts[期刊论文]，CATALYSIS SCIENCE & TECHNOLOGY，2017-12-21
  • 90. DOI Ren, Dongmei;Cheng, Gang;Li, Jianwei;Li, Jinbing;Dai, Wujun;Sun, XinXin;Cheng, Daojian
    Effect of Rhenium Loading Sequence on Selectivity of Ag-Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-12-01
  • 91. DOI Huang, Xingkai;Wu, Dengfeng;Cheng, Daojian
    Porous Co2P nanowires as high efficient bifunctional catalysts for 4-nitrophenol reduction and sodium borohydride hydrolysis[期刊论文]，JOURNAL OF COLLOID AND INTERFACE SCIENCE，2017-12-01
  • 92. DOI Ren, Dongmei;Xu, Haoxiang;Li, Jianwei;Li, Jinhing;Cheng, Daojian
    Origin of enhanced ethylene oxide selectivity by Cs-promoted silver catalyst[期刊论文]，MOLECULAR CATALYSIS，2017-11-01
  • 93. DOI Wei, Yongsheng;Huang, Xingkai;Wang, Junyan;Yu, Haiyan;Zhao, Xinsheng;Cheng, Daojian
    Synthesis of bifunctional non-noble monolithic catalyst Co-W-P/carbon cloth for sodium borohydride hydrolysis and reduction of 4-nitrophenol[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2017-10-12
  • 94. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 95. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 96. DOI Yan, Bailu;Zhao, Zheng;Zhou, Yingcheng;Yuan, Wenyan;Li, Jian;Wu, Jun;Cheng, Daojian
    A particle swarm optimization algorithm with random learning mechanism and Levy flight for optimization of atomic clusters[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2017-10-01
  • 97. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 98. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 99. DOI Yang, Yang;Dai, Changqing;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    A full understanding of oxygen reduction reaction mechanism on Au(111) surface[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2017-09-13
  • 100. DOI Shan, Aixian;Chen, Chinping;Zhang, Wei;Cheng, Daojian;Shen, Xi;Yu, Richeng;Wang, Rongming
    Giant enhancement and anomalous temperature dependence of magnetism in monodispersed NiPt2 nanoparticles[期刊论文]，NANO RESEARCH，2017-09-01
  • 101. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 102. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 103. DOI Zhang, Xing;Wu, Dengfeng;Cheng, Daojian
    Component-dependent electrocatalytic activity of PdCu bimetallic nanoparticles for hydrogen evolution reaction[期刊论文]，ELECTROCHIMICA ACTA，2017-08-20
  • 104. DOI Zhao, Zheng;Wang, Fang-Hui;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Phase stability and segregation behavior of nickel-based nanoalloys based on theory and simulation[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2017-06-25
  • 105. DOI Wu, Dengfeng;Zhang, Wei;Cheng, Daojian
    Facile Synthesis of Cu/NiCu Electrocatalysts Integrating Alloy, Core Shell, and One-Dimensional Structures for Efficient Methanol Oxidation Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2017-06-14
  • 106. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 107. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 108. DOI Zhang, Wei;Shan, Shiyao;Luo, Jin;Fisher, Adrian;Chen, Jian-Feng;Zhong, Chuan-Jian;Zhu, Jiqin;Chen, Daojian
    Origin of Enhanced Activities for CO Oxidation and O-2 Reaction over Composition-Optimized Pd50Cu50 Nanoalloy Catalysts[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2017-05-25
  • 109. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin;Cheng, Daojian
    Mechanistic insight into the facet-dependent selectivity of ethylene epoxidation on Ag nanocatalysts[期刊论文]，APPLIED CATALYSIS A: GENERAL，2017-05-25
  • 110. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin
    Ni (111)-supported graphene as a potential catalyst for high-efficient CO oxidation[期刊论文]，CARBON，2017-05-01
  • 111. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi
    Design of High-Performance Pd-Based Alloy Nanocatalysts for Direct Synthesis of H2O2[期刊论文]，ACS CATALYSIS，2017-03-01
  • 112. DOI Yu, Haiyan;Cao, Dapeng;Fisher, Adrian;Johnston, Roy L.;Cheng, Daojian
    Size effect on the adsorption and dissociation of CO2 on Co nanoclusters[期刊论文]，APPLIED SURFACE SCIENCE，2017-02-28
  • 113. DOI Lian, Xiaojun;Zhao, Zheng;Cheng, Daojian
    Recent progress on triphenylamine materials: synthesis, properties, and applications[期刊论文]，MOLECULAR CRYSTALS AND LIQUID CRYSTALS，2017-01-01
  • 114. DOI Wu, Dengfeng;Xu, Haoxiang;Cao, Dapeng;Fisher, Adrian;Gao, Yi;Cheng, Daojian
    PdCu alloy nanoparticle-decorated copper nanotubes as enhanced electrocatalysts: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-12-09
  • 115. DOI Dai, Changqing;Yang, Yang;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Interaction of CO2 with metal cluster-functionalized ionic liquids[期刊论文]，JOURNAL OF CO2 UTILIZATION，2016-12-01
  • 116. DOI Wei, Chengcheng;Zhao, Zheng;Fisher, Adrian;Zhu, Jiqin;Cheng, Daojian
    Theoretical Study on the Structures and Thermal Properties of Ag-Pt-Ni Trimetallic Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-11-01
  • 117. DOI Cheng, Daojian;Wu, Dengfeng;Xu, Haoxiang;Fisher, Adrian
    Composition-controlled Synthesis of PtCuNPs Shells on Copper Nanowires as Electrocatalysts[期刊论文]，CHEMISTRYSELECT，2016-09-16
  • 118. DOI Yu, Haiyan;Fisher, Adrian;Cheng, Daojian;Cao, Dapeng
    Cu,N-codoped Hierarchical Porous Carbons as Electrocatalysts for Oxygen Reduction Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2016-08-24
  • 119. DOI Yang, Yang;Dai, Changqing;Shen, Yanchun;Fisher, Adrian;Cheng, Daojian
    Design of binary and ternary platinum shelled electrocatalysts with inexpensive metals for the oxygen reduction reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2016-08-10
  • 120. DOI Liu, Xinyue;Dai, Changqing;Wu, Dengfeng;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Facile Synthesis of PdAgCo Trimetallic Nanoparticles for Formic Acid Electrochemical Oxidation[期刊论文]，CHEMISTRY LETTERS，2016-07-05
  • 121. DOI 程道建
    双金属纳米电催化:理论和实验研究[会议论文]，中国化学会第30届学术年会摘要集-第二十九分会：电化学材料，2016-07-01
  • 122. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    A density functional theory study of sulfur adsorption on Ag-Au nanoalloys[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2016-06-01
  • 123. DOI 程道建
    双金属纳米催化:理论和实验研究[会议论文]，第七届全国物理无机化学学术会议论文集，2016-05-06
  • 124. DOI Zhao, Zheng;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Magnetic Properties of Pt-Based Nanoalloys: A Critical Review[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-05-01
  • 125. DOI Zhao, Zheng;Fisher, Adrian;Cheng, Daojian
    Phase diagram and segregation of Ag-Co nanoalloys: insights from theory and simulation[期刊论文]，NANOTECHNOLOGY，2016-03-18
  • 126. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Huan, Haifeng;Cao, Dapeng
    Enhanced near-infrared shielding ability of (Li, K)-codoped WO3 for smart windows: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-02-09
  • 127. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Highly sensitive and selective colorimetric detection of sulphide using Ag-Au nanoalloys: a DFT study[期刊论文]，RSC ADVANCES，2016-01-01
  • 128. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文]，MOLECULAR SIMULATION，2016-01-01
  • 129. DOI Chang, Le;Liu, Zhiping;Cheng, Daojian
    Optical properties of Ag-Au nanoclusters for sulphide sensing from TDDFT calculations[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2015-12-25
  • 130. DOI Zhang, Wei;Cui, Rong;Wu, Hao;Zhu, Jiqin;Cheng, Daojian
    CO oxidation mechanism on a MgO(100) supported PtxAu3-x clusters[期刊论文]，APPLIED SURFACE SCIENCE，2015-11-30
  • 131. DOI Zhang, Wei;Sumer, Aslihan;Jellinek, Julius;Cheng, Daojian
    Morphology Tailoring of Pt Nanocatalysts for the Oxygen Reduction Reaction: The Paradigm of Pt-13[期刊论文]，CHEMNANOMAT，2015-11-01
  • 132. DOI Wu, Dengfeng;Cheng, Daojian
    Core/shell AgNi/PtAgNi nanoparticles as methanol-tolerant oxygen reduction electrocatalysts[期刊论文]，ELECTROCHIMICA ACTA，2015-10-20
  • 133. DOI wang,qian,fang,yu,孟洪,毋伟,初广文,邹海魁,程道建,陈建峰
    Enhanced simulated sunlight induced photocatalytic activity by pomegranate-like S doped SnO2@TiO2 spheres[期刊论文]，Colloids and Surfaces A: Physicochemical and Engineering Aspects，2015-10-05
  • 134. DOI Niu, Mang;Tan, Huaqiao;Cheng, Daojian;Sun, Zaicheng;Cao, Dapeng
    Bandgap engineering of Magnei phase TinO2n-1: Electron-hole self-compensation[期刊论文]，JOURNAL OF CHEMICAL PHYSICS，2015-08-07
  • 135. DOI Wu, Dengfeng;Dai, Changqing;Li, Shaojie;Cheng, Daojian
    Shape-controlled Synthesis of PdCu Nanocrystals for Formic Acid Oxidation[期刊论文]，CHEMISTRY LETTERS，2015-08-05
  • 136. DOI Niu, Mang;Cui, Rong;Wu, Hao;Cheng, Daojian;Cao, Dapeng
    Enhancement Mechanism of the Conversion Effficiency of Dye-Sensitized Solar Sells Based on Nitrogen-, Fluorine-, and Iodine-Doped TiO2 Photoanodes[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-06-18
  • 137. DOI Yang, Yang;Zhao, Zheng;Cui, Rong;Wu, Hao;Cheng, Daojian
    Structures, Thermal Stability, and Chemical Activity of Crown-Jewel-Structured Pd-Pt Nanoalloys[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-05-21
  • 138. DOI Wang, Jian;Yuan, Wenyan;Cheng, Daojian
    Hybrid genetic-particle swarm algorithm: An efficient method for fast optimization of atomic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2015-05-01
  • 139. DOI Xu, Haoxiang;Cheng, Daojian
    Effect of the Passivating Ligands on the Geometric and Electronic Properties of Au-Pd Nanoalloys[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2015-05-01
  • 140. DOI Chen, Bing;Cheng, Daojian;Zhu, Jiqin
    Synthesis of PtCu nanowires in nonaqueous solvent with enhanced activity and stability for oxygen reduction reaction[期刊论文]，JOURNAL OF POWER SOURCES，2014-12-01
  • 141. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Cao, Dapeng
    Design of the Alkali-Metal-Doped WO3 as a Near-Infrared Shielding Material for Smart Window[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2014-11-19
  • 142. DOI Li, Shaojie;Cheng, Daojian;Qiu, Xiangguo;Cao, Dapeng
    Synthesis of Cu@Pd core-shell nanowires with enhanced activity and stability for formic acid oxidation[期刊论文]，ELECTROCHIMICA ACTA，2014-10-10
  • 143. DOI Chang, Le;Xu, Haoxiang;Cheng, Daojian
    Role of ligand type on the geometric and electronic properties of Ag-Au bimetallic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2014-10-01
  • 144. DOI Zhao, Zheng;Li, Mingjiang;Cheng, Daojian;Zhu, Jiqin
    Understanding the structural properties and thermal stabilities of Au-Pd-Pt trimetallic clustersle[期刊论文]，CHEMICAL PHYSICS，2014-09-30
  • 145. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Fluorite TiO2(111) Surface Phase for Enhanced Visible-Light Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-09-04
  • 146. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    SiH/TiO2 and GeH/TiO2 Heterojunctions: Promising TiO2-based Photocatalysts under Visible Light[期刊论文]，SCIENTIFIC REPORTS，2014-05-02
  • 147. DOI Cheng, Daojian;Xu, Haoxiang;Fortunelli, Alessandro
    Tuning the catalytic activity of Au-Pd nanoalloys in CO oxidation via composition[期刊论文]，JOURNAL OF CATALYSIS，2014-05-01
  • 148. DOI Fang, Yu;Cheng, Daojian;Wu, Wei
    Understanding electronic and optical properties of N-Sn codoped anatase TiO2[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-04-01
  • 149. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding the Mechanism of Photocatalysis Enhancements in the Graphene-like Semiconductor Sheet/TiO2 Composites[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-03-20
  • 150. DOI Cheng, Daojian;Zhang, Minming;Chen, Jianfeng;Yang, Chenxi;Zeng, Xiaofei;Cao, Dapeng
    Computer Screening of Dopants for the Development of New SnO2-Based Transparent Conducting Oxides[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-30
  • 151. DOI Yang, Yang;Cheng, Daojian
    Role of Composition and Geometric Relaxation in CO2 Binding to Cu-Ni Bimetallic Clusters[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-09
  • 152. DOI Zhang, Wei;Cheng, Daojian;Zhu, Jiqin
    Theoretical study of CO catalytic oxidation on free and defective graphene-supported Au-Pd bimetallic clusters[期刊论文]，RSC ADVANCES，2014-01-01
  • 153. DOI Cheng, Daojian;Qiu, Xiangguo;Yu, Haiyan
    Enhancing oxygen reduction reaction activity of Pt-shelled catalysts via subsurface alloying[期刊论文]，PHYSICAL CHEMISTRY CHEMICAL PHYSICS，2014-01-01
  • 154. DOI Tan, Huaqiao;Zhao, Zhao;Niu, Mang;Mao, Chengyu;Cao, Dapeng;Cheng, Daojian;Feng, Pingyun;Sun, Zaicheng
    A facile and versatile method for preparation of colored TiO2 with enhanced solar-driven photocatalytic activity[期刊论文]，NANOSCALE，2014-01-01
  • 155. DOI Li, Mingjiang;Li, Shaojie;Cheng, Daojian
    Influence of adsorbates on the segregation properties of Au-Pd bimetallic clusters[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-01-01
  • 156. DOI Li, Mingjiang;Cheng, Daojian
    Molecular Dynamics Simulation of the Melting Behavior of Crown-Jewel Structured Au-Pd Nanoalloys[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-09-12
  • 157. DOI Cheng, Daojian;Yuan, Shuai;Ferrando, Riccardo
    Structure, chemical ordering and thermal stability of Pt-Ni alloy nanoclusters[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2013-09-04
  • 158. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding Photoelectrochennical Properties of B-N Codoped Anatase TiO2 for Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-08-08
  • 159. DOI Cheng, Daojian;Negreiros, Fabio R.;Apra, Edoardo;Fortunelli, Alessandro
    Computational Approaches to the Chemical Conversion of Carbon Dioxide[期刊论文]，CHEMSUSCHEM，2013-06-01
  • 160. DOI Fang, Yu;Cheng, Daojian;Niu, Mang;Yi, Yongjun;Wu, Wei
    Tailoring the electronic and optical properties of rutile TiO2 by (Nb + Sb, C) codoping from DFT plus U calculations[期刊论文]，CHEMICAL PHYSICS LETTERS，2013-04-19
  • 161. DOI Cheng, Daojian;Cao, Dapeng;Wang, Wenchuan
    Hydrogen storage in porous materials and nanoalloys as catalysts for fuel cell application by using multiscale simulation and experimental methods[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2013-04-07
  • 162. DOI Cheng, Daojian;Jiang, Kun
    Structural stability and kinetics of small carbon clusters on a bimetallic Cu/Ni(111) surface: A first-principles study[期刊论文]，SURFACE SCIENCE，2013-03-01
  • 163. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Enhanced photoelectrochemical performance of anatase TiO2 by metal-assisted S-O coupling for water splitting[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2013-02-06
[+][-] 2027年
  • 1. DOI Zhang, Huimin;Liu, Wenhao;Li, Zhenhao;Qiao, Liang;Chi, Kebin;Guo, Xiaoyan;Cao, Dong;Cheng, Daojian
    Constructing CoP/Ni2P Heterostructure Confined Ru Sub-Nanoclusters for Enhanced Water Splitting in Wide pH Conditions[期刊论文]，Advanced Science，2024-09-18
  • 2. DOI Cao, Dong;Zhang, Zhirong;Cui, Yahui;Zhang, Runhao;Zhang, Lipeng;Zeng, Jie;Cheng, Daojian
    One-Step Approach for Constructing High-Density Single-Atom Catalysts toward Overall Water Splitting at Industrial Current Densities[期刊论文]，Angewandte Chemie-International Edition，2023-02-20
  • 3. DOI Sun, Jindong;Xu, Haoxiang;Ma, Haowen;Zhan, Xuecheng;Zhu, Jiqin;Cheng, Daojian
    Isoprene selective hydrogenation using AgCu-promoted Pd nanoalloys[期刊论文]，FARADAY DISCUSSIONS，2023-01-31
  • 4. DOI Liu, Tianpeng;Liu, Wenhao;Ma, Mengyao;Guo, Linke;Cui, Rong;Cheng, Daojian;Cao, Dong
    Constructing nickel vanadium phosphide nanoarrays with highly active heterointerfaces for water oxidation in alkali media[期刊论文]，ELECTROCHIMICA ACTA，2023-01-20
  • 5. DOI Cao, Dong;Huang, Xiaoyu;Zhang, Huimin;Liu, Wenhao;Cheng, Daojian
    Constructing porous RuCu nanotubes with highly efficient alloy phase for water splitting in different pH conditions[期刊论文]，Chemical Engineering Journal，2023-01-15
  • 6. DOI Wang, Jiayi;Xu, Haoxiang;Che, Chunxia;Zhu, Jiqin;Cheng, Daojian
    Rational Design of PdAg Catalysts for Acetylene Selective Hydrogenation via Structural Descriptor-based Screening Strategy[期刊论文]，ACS Catalysis，2023-01-06
  • 7. DOI Zhang, Huimin;Guo, Xiaoyan;Liu, Wenhao;Wu, Dengfeng;Cao, Dong;Cheng, Daojian
    Regulating surface composition of platinum-copper nanotubes for enhanced hydrogen evolution reaction in all pH values[期刊论文]，Journal of Colloid and Interface Science，2023-01-01
  • 8. DOI Cao, Dong;Shao, Jie;Cui, Yahui;Zhang, Lipeng;Cheng, Daojian
    Interfacial Engineering of Copper–Nickel Selenide Nanodendrites for Enhanced Overall Water Splitting in Alkali Condition[期刊论文]，Small，2023-01-01
  • 9. DOI Wang, Xuning;Xu, Haoxiang;Luo, Yibin;Cheng, Daojian
    High Selective Direct Synthesis of H2O2 over Pd-1@gamma-Al2O3 Single-Atom Catalyst[期刊论文]，CHEMCATCHEM，2022-11-08
  • 10. DOI Deng, Zhuoran;Zhao, Liqiang;Cheng, Daojian
    A high-throughput catalyst synthesis system for Ag-based catalysts[期刊论文]，Review of Scientific Instruments，2022-11-01
  • 11. DOI Xu, Xiaopei;Peng, Zhipeng;Xu, Haoxiang;Cheng, Daojian
    Computational screening of nonmetal dopants to active MoS2 basal-plane for hydrogen evolution reaction via structural descriptor[期刊论文]，Journal of Catalysis，2022-10-31
  • 12. DOI 曹东,许昊翔,Hongliang Li,Chen Feng,Jie Zeng,程道建
    Volcano-type relationship between oxidation states and catalytic activity of single-atom catalysts towards hydrogen evolution[期刊论文]，Nature Communications，2022-10-04
  • 13. DOI Yan, Jingjing;Xu, Haoxiang;Chang, Le;Lin, Aijun;Cheng, Daojian
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single-atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 14. DOI 燕晶晶,许昊翔,常乐,林爱军,程道建
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 15. DOI Cheng, Feipeng;Cheng, Jihao;Nan, Yang;Xie, Yuan;Yang, Tongqian;Cheng, Daojian;Zhu, Jiqin;Xu, Haoxiang
    Enhancing oxidative hydration of ethylene towards ethylene glycol over metal-modified titanosilicate catalysts[期刊论文]，Applied Catalysis A: General，2022-08-05
  • 16. DOI Wen, Qi-Xing;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Design of CuCs-doped Ag-based catalyst for ethylene epoxidation[期刊论文]，Chinese Journal of Chemical Physics，2022-08-01
  • 17. DOI 张眉佳,许昊翔,罗一斌,朱吉钦,程道建
    Enhancing the catalytic performance of PdAu catalysts by W induced strong interaction for the direct synthesis of H2O2[期刊论文]，Catalysis Science & Technology，2022-07-26
  • 18. DOI Deng, Zhuoran;Zhou, Yingcheng;Zhao, Liqiang;Cheng, Daojian
    Structures and structural evolution of M-N (M = Pt, Ag, Au, N=2-20) from combined revised particle swarm optimization and density function theory[期刊论文]，MOLECULAR SIMULATION，2022-07-03
  • 19. DOI Zhang, Huimin;Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Carbon-based material-supported single-atom catalysts for energy conversion[期刊论文]，ISCIENCE，2022-06-17
  • 20. DOI 陈志强;车春霞;吴登峰;温翯;韩伟;张峰;许昊翔;程道建
    乙炔选择性加氢催化剂研究进展[期刊论文]，化工进展，2022-03-17
  • 21. DOI Liu, Ning;Cao, Dong;Liu, Wenhao;Zhang, Huimin;Zhu, Yinhai;Chang, Le;Wu, Dengfeng;Cheng, Daojian
    Constructing La-doped ultrathin Co-based nanostructured electrocatalysts for high-performance water oxidation process[期刊论文]，International Journal of Hydrogen Energy，2022-01-01
  • 22. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Branch-leaf-shaped CuNi@NiFeCu nanodendrites as highly efficient electrocatalysts for overall water splitting[期刊论文]，Applied Catalysis B-Environmental，2021-12-05
  • 23. DOI Zhang, Meijia;Luo, Yibin;Wu, Dengfeng;Li, Qian;Xu, Haoxiang;Cheng, Daojian
    Promoter role of tungsten in W-Pd/Al2O3 catalyst for direct synthesis of H2O2: Modification of Pd/PdO ratio[期刊论文]，APPLIED CATALYSIS A-GENERAL，2021-11-25
  • 24. DOI 孙晋冬;展学成;吴登峰;谢元;马好文;许昊翔;程道建
    碳四炔烃选择性加氢催化剂研究进展[期刊论文]，石油学报(石油加工)，2021-10-15
  • 25. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Construction of Dual-Site Atomically Dispersed Electrocatalysts with Ru-C-5 Single Atoms and Ru-O-4 Nanoclusters for Accelerated Alkali Hydrogen Evolution[期刊论文]，Small，2021-08-01
  • 26. DOI Cao, Dong;Wang, Jiayi;Zhang, Huimin;Xu, Haoxiang;Cheng, Daojian
    Growth of IrCu nanoislands with rich IrCu/Ir interfaces enables highly efficient overall water splitting in non-acidic electrolytes[期刊论文]，Chemical Engineering Journal，2021-07-15
  • 27. DOI Zhu, Yinhai;Cao, Dong;Liu, Ning;Cheng, Daojian
    One-step synthesis of atomic Ru doped ultra-thin Co(OH)(2) nanosheets for oxygen evolution reaction in different pH values[期刊论文]，International Journal of Hydrogen Energy，2021-06-28
  • 28. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Metal Dopants in Enhancing the Selectivity of Ag-Catalyzed Ethylene Epoxidation: Optimizing Oxophilicity of Reaction Site via Cocatalytic Mechanism[期刊论文]，ACS Catalysis，2021-03-19
  • 29. DOI 吴建国;吴登峰;程道建
    丙烷脱氢制丙烯用单原子催化剂研究进展[期刊论文]，化工进展，2021-03-16
  • 30. DOI Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Review on Synthesis and Catalytic Coupling Mechanism of Highly Active Electrocatalysts for Water Splitting[期刊论文]，Energy Technology，2021-02-01
  • 31. DOI Ma, Haowen;Xu, Xiaopei;Xu, Haoxiang;Feng, Huixia;Xie, Yuan;Cheng, Daojian
    Understanding composition-dependent catalytic performance of PdAg for the hydrogenation of 1,3-butadiene to 1-butene[期刊论文]，CATALYSIS COMMUNICATIONS，2021-01-15
  • 32. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文]，Advances in Physics-X，2021-01-01
  • 33. DOI Huang, Xingkai;Xu, Haoxiang;Cao, Dong;Cheng, Daojian
    Interface construction of P-Substituted MoS2 as efficient and robust electrocatalyst for alkaline hydrogen evolution reaction[期刊论文]，Nano Energy，2020-12-01
  • 34. DOI Yang, Liu,许昊翔,Liu, Huibing,曾晓飞,程道建,黄燕,Zheng, Lirong,Cao, Rui,曹达鹏
    Oxygen-Reconstituted Active Species of Single-Atom Cu Catalysts for Oxygen Reduction Reaction[期刊论文]，Research，2020-10-05
  • 35. DOI Xu, Xiaopei,许昊翔,程道建
    Identification of the Anti-triangular Etched MoS2 with Comparative Activity with Commercial Pt for Hydrogen Evolution Reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-10-04
  • 36. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Growth of Highly Active Amorphous RuCu Nanosheets on Cu Nanotubes for the Hydrogen Evolution Reaction in Wide pH Values[期刊论文]，Small，2020-09-01
  • 37. DOI 许昊翔,程道建
    First-principles-aided Thermodynamic Modeling of Transition-metal Heterogeneous Catalysts: A review.[期刊论文]，Green Energy & Environment，2020-07-14
  • 38. DOI Xu, Haoxiang;Cheng, Daojian
    First-principles-aided thermodynamic modeling of transition-metal heterogeneous catalysts: A review[期刊论文]，GREEN ENERGY & ENVIRONMENT，2020-07-01
  • 39. DOI Che, Chunxia;Xu, Haoxiang;Wen, He;Gou, Galian;Cheng, Daojian
    Theoretical Study on the Structural, Thermal and Phase Stability of Pt-Cu Alloy Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2020-05-01
  • 40. DOI Zhang, Wei;Zhu, Jiqin;Cheng, Daojian;Zeng, Xiao Cheng
    PtCoNi Alloy Nanoclusters for Synergistic Catalytic Oxygen Reduction Reaction[期刊论文]，ACS APPLIED NANO MATERIALS，2020-03-01
  • 41. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Construction of Defect-Rich RhCu Nanotubes with Highly Active Rh3Cu1 Alloy Phase for Overall Water Splitting in All pH Values[期刊论文]，ADVANCED ENERGY MATERIALS，2020-03-01
  • 42. DOI Wu, Dengfeng;Zhang, Wei;Lin, Aijun;Cheng, Daojian
    Low Pt-Content Ternary PtNiCu Nanoparticles with Hollow Interiors and Accessible Surfaces as Enhanced Multifunctional Electrocatalysts[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2020-02-26
  • 43. DOI Wu, Dengfeng;Yang, Yang;Dai, Changqing;Cheng, Daojian
    Enhanced oxygen reduction activity of PtCu nanoparticles by morphology tuning and transition-metal doping[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-02-07
  • 44. DOI Huang, Xingkai;Xu, Xiaopei;Luan, Xiaoxu;Cheng, Daojian
    CoP nanowires coupled with CoMoP nanosheets as a highly efficient cooperative catalyst for hydrogen evolution reaction[期刊论文]，NANO ENERGY，2020-02-01
  • 45. DOI Zhou, Yingcheng;Zhao, Zheng;Cheng, Daojian
    Cluster structure prediction via revised particle-swarm optimization algorithm[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2020-02-01
  • 46. DOI Li, Lin-Xin;Xie, Zhi-Hui;Fernandez, Carlos;Wu, Liang;Cheng, Daojian;Jiang, Xiao-Hui;Zhong, Chuan-Jian
    Development of a thiophene derivative modified LDH coating for Mg alloy corrosion protection[期刊论文]，ELECTROCHIMICA ACTA，2020-01-10
  • 47. DOI Zhang, Junmeng;Xu, Xiaopei;Yang, Liu;Cheng, Daojian;Cao, Dapeng
    Single-Atom Ru Doping Induced Phase Transition of MoS2 and S Vacancy for Hydrogen Evolution Reaction[期刊论文]，SMALL METHODS，2019-12-11
  • 48. DOI Zhao, Zheng,许昊翔,Feng, Zongyu,Zhang, Yongqi,Cui, Meisheng,曹达鹏,程道建
    Design of High-Performance Co-Based Alloy Nanocatalysts for the Oxygen Reduction Reaction[期刊论文]，Chemistry - A European Journal，2019-12-03
  • 49. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Chlorine in Selectivity Enhancement of Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-11-27
  • 50. DOI Xu, Xiaopei;Xu, Haoxiang;Cheng, Daojian
    Design of high-performance MoS2 edge supported single-metal atom bifunctional catalysts for overall water splitting via a simple equation[期刊论文]，NANOSCALE，2019-11-14
  • 51. DOI Wu, Dengfeng;Cheng, Daojian
    Structure-controlled synthesis of one-dimensional PdCu nanoscatalysts via a seed-mediated approach for oxygen reduction reaction[期刊论文]，APPLIED SURFACE SCIENCE，2019-11-01
  • 52. DOI Huang, Xiaoyu;Yang, Yang;Cheng, Daojian
    Hydrogen generation from formic acid decomposition on Pd-Cu nanoalloys[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-09-13
  • 53. DOI Zhang, Wei;Deibert, David L.;Cheng, Daojian;Zeng, Xiao Cheng
    Magnetism in bimetallic PtxNiN-x clusters via cross-atomic coupling[期刊论文]，JOURNAL OF MATERIALS CHEMISTRY C，2019-08-14
  • 54. DOI Ma, Haowen;Yang, Yang;Feng, Huixia;Cheng, Daojian
    DFT Study of Pyrolysis Gasoline Hydrogenation on Pd(100), Pd(110) and Pd(111) Surfaces[期刊论文]，CATALYSIS LETTERS，2019-08-01
  • 55. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Fortunelli, Alessandro;Cheng, Daojian
    Selectivity-Driven Design of the Ag-Cu Alloys for the Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-07-24
  • 56. DOI Cao, Dong;Cheng, Daojian
    One-pot synthesis of copper-nickel sulfide nanowires for overall water splitting in alkaline media[期刊论文]，CHEMICAL COMMUNICATIONS，2019-07-18
  • 57. DOI Huang, Xingkai;Xu, Xiaopei;Li, Chao;Wu, Dengfeng;Cheng, Daojian;Cao, Dapeng
    Vertical CoP Nanoarray Wrapped by N,P-Doped Carbon for Hydrogen Evolution Reaction in Both Acidic and Alkaline Conditions[期刊论文]，ADVANCED ENERGY MATERIALS，2019-06-01
  • 58. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Cheng, Daojian
    The synergistic effect between crystal planes and promoters on Ag-catalyzed ethylene epoxidation[期刊论文]，APPLIED SURFACE SCIENCE，2019-05-15
  • 59. DOI Yang, Liu;Xu, Haoxiang;Liu, Huibing;Cheng, Daojian;Cao, Dapeng
    Active Site Identification and Evaluation Criteria of In Situ Grown CoTe and NiTe Nanoarrays for Hydrogen Evolution and Oxygen Evolution Reactions[期刊论文]，SMALL METHODS，2019-05-10
  • 60. DOI Yang, Chenxi;Wang, Guoqing;Liang, Aimin;Yue, Yi;Peng, Hui;Cheng, Daojian
    Understanding the role of Au in the selective hydrogenation of acetylene on trimetallic PdAgAu catalytic surface[期刊论文]，CATALYSIS COMMUNICATIONS，2019-05-05
  • 61. DOI Li, Pengcheng;Wu, Dengfeng;Dai, Changqing;Huang, Xingkai;Li, Chao;Yin, Zhen;Zhou, Song;Lv, Zhengang;Cheng, Daojian;Zhu, Jiqin;Xu, Jian;Liu, Xi
    Controlled Synthesis of Copper-Doped Molybdenum Carbide Catalyst with Enhanced Activity and Stability for Hydrogen Evolution Reaction[期刊论文]，CATALYSIS LETTERS，2019-05-01
  • 62. DOI Elouarzaki Kamal,Wang Yian,Kannan Vishvak,许昊翔,程道建,Lee Jong-Min,Fisher Adrian C.
    Hydrogenase-Like Electrocatalytic Activation and Inactivation Mechanism by Three-Dimensional Binderless Molecular Catalyst[期刊论文]，ACS Applied Energy Materials，2019-04-09
  • 63. DOI Xu, Haoxiang;Cheng, Daojian
    Rational design of transition metal nanocatalyst by structure descriptor[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2019-03-31
  • 64. DOI Yang, Mengjie;Wu, Dengfeng;Cheng, Daojian
    Biomass-derived porous carbon supported Co-CoO yolk-shell nanoparticles as enhanced multifunctional electrocatalysts[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-03-08
  • 65. DOI Zhao, Zheng;Kong, Kewei;Wang, Shixian;Zhou, Yingcheng;Cheng, Daojian;Wang, Wenchuan;Zeng, Xiao Cheng;Li, Hui
    Understanding Hygroscopic Nucleation of Sulfate Aerosols: Combination of Molecular Dynamics Simulation with Classical Nucleation Theory[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY LETTERS，2019-03-07
  • 66. DOI Lv, Yanlong,朱琳,许昊翔,Yang, Liu,刘志平,程道建,Cao, Xiaohua,Yun Jimmy,曹达鹏
    Core/shell Template-derived Co, N-doped Carbon Bifunctional Electrocatalysts for Rechargeable Zn-air Battery[期刊论文]，Engineered Science，2019-02-28
  • 67. DOI Zhao, Zheng;Xu, Haoxiang;Gao, Yi;Cheng, Daojian
    Universal description of heating-induced reshaping preference of core-shell bimetallic nanoparticles[期刊论文]，NANOSCALE，2019-01-21
  • 68. DOI Yang, Yang,Zhao, Zheng,程道建,朱吉钦
    Effect of Size and Composition on the Structural Stability of Pt–Ni Nanoalloys[期刊论文]，Journal of Cluster Science，2019-01-14
  • 69. DOI Nan, Yang;Wang, Yinuo;Cao, Dong;Yang, Yang;Cheng, Daojian
    Adsorption and dissociation of borohydride on different Ir-Ni alloy surfaces[期刊论文]，Appl Surf Sci，2019-01-01
  • 70. DOI Yang, Yang,许昊翔,曹达鹏,曾晓成,程道建
    Hydrogen Production via Efficient Formic Acid Decomposition: Engineering the Surface Structure of Pd-Based Alloy Catalysts by Design[期刊论文]，ACS Catalysis，2018-12-07
  • 71. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Zhu, Jiqin;Cheng, Daojian
    Facet-dependent diffusion of atomic oxygen on Ag surfaces[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2018-12-01
  • 72. DOI Chang, Le;Cheng, Daojian;Sementa, Luca;Fortunelli, Alessandro
    Hydrogen evolution reaction (HER) on Au@Ag ultrananoclusters as electro-catalysts[期刊论文]，NANOSCALE，2018-10-07
  • 73. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi;Zeng, Xiao Cheng
    Assessment of Catalytic Activities of Gold Nanoclusters with Simple Structure Descriptors[期刊论文]，ACS CATALYSIS，2018-10-01
  • 74. DOI Yang, Yang;Dai, Changqing;Wu, Dengfeng;Liu, Zhiping;Cheng, Daojian
    The Size Effect of PdCu Bimetallic Nanoparticles on Oxygen Reduction Reaction Activity[期刊论文]，CHEMELECTROCHEM，2018-09-12
  • 75. DOI Lian, Xiaojun;Niu, Mang;Huang, Yan;Cheng, Daojian
    MoS2-CdS heterojunction with enhanced photocatalytic activity: A first principles study[期刊论文]，JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS，2018-09-01
  • 76. DOI Huang, Yichao;Hu, Jun;Xu, Haoxiang;Bian, Wei;Ge, Jingxuan;Zang, Dejin;Cheng, Daojian;Lv, Yaokang;Zhang, Cheng;Gu, Jing;Wei, Yongge
    Fine Tuning Electronic Structure of Catalysts through Atomic Engineering for Enhanced Hydrogen Evolution[期刊论文]，ADVANCED ENERGY MATERIALS，2018-08-27
  • 77. DOI Miao, Xue-Pei;Cheng, Dao-Jian;Dai, Ya-Dong;Meng, Yan;Li, Xiao-Yu
    Origin of Modulus Improvement for Epoxide-terminated Hyperbranched Poly(ether sulphone)/DGEBA/TETA Systems[期刊论文]，CHINESE JOURNAL OF POLYMER SCIENCE，2018-08-01
  • 78. DOI Chang, Le;Baseggio, Oscar;Sernenta, Luca;Cheng, Daojian;Fronzoni, Giovanna;Toffoli, Daniele;Apra, Edoardo;Stener, Mauro;Fortunelli, Alessandro
    Individual Component Map of Rotatory Strength and Rotatory Strength Density Plots As Analysis Tools of Circular Dichroism Spectra of Complex Systems[期刊论文]，JOURNAL OF CHEMICAL THEORY AND COMPUTATION，2018-07-01
  • 79. DOI Elouarzaki, Kamal;Cheng, Daojian;Fisher, Adrian C.;Lee, Jong-Min
    Coupling orientation and mediation strategies for efficient electron transfer in hybrid biofuel cells[期刊论文]，NATURE ENERGY，2018-07-01
  • 80. DOI Wang, Zegao;Li, Qiang;Xu, Haoxiang;Dahl-Petersen, Christian;Yang, Qian;Cheng, Daojian;Cao, Dapeng;Besenbacher, Flemming;Lauritsen, Jeppe V.;Helveg, Stig;Dong, Mingdong
    Controllable etching of MoS2 basal planes for enhanced hydrogen evolution through the formation of active edge sites[期刊论文]，NANO ENERGY，2018-07-01
  • 81. DOI Yang, Liu;Cheng, Daojian;Zeng, Xiaofei;Wan, Xin;Shui, Jianglan;Xiang, Zhonghua;Cao, Dapeng
    Unveiling the high-activity origin of single-atom iron catalysts for oxygen reduction reaction[期刊论文]，PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA，2018-06-26
  • 82. DOI 杨洋,Yu, Haiyan,Cai, Yushun,Ferrando, Riccardo,程道建
    Origin of enhanced stability and oxygen adsorption capacity of mediumsized Pt–Ni nanoclusters[期刊论文]，Journal of Physics: Condensed Matter，2018-06-22
  • 83. DOI Yu, Haiyan,Yang, Liu,程道建,曹达鹏
    Zeolitic-imidazolate Framework (ZIF)@ZnCo-ZIF Core-shell Template Derived Co, N-doped Carbon Catalysts for Oxygen Reduction Reaction[期刊论文]，Engineered Science，2018-06-02
  • 84. DOI 吴登峰,Zhang, Xin,朱吉钦,程道建
    Concerted Catalysis on Tanghulu-like Cu@Zeolitic Imidazolate Framework-8 (ZIF-8) Nanowires with Tuning Catalytic Performances for 4-nitrophenol Reduction[期刊论文]，Engineered Science，2018-05-21
  • 85. DOI Huang, Yan;Wu, Dengfeng;Cao, Dapeng;Cheng, Daojian
    Facile preparation of biomass-derived bifunctional electrocatalysts for oxygen reduction and evolution reactions[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2018-05-03
  • 86. DOI Xu, Haoxiang;Cheng, Daojian;Cao, Dapeng;Zeng, Xiao Cheng
    A universal principle for a rational design of single-atom electrocatalysts[期刊论文]，NATURE CATALYSIS，2018-05-01
  • 87. DOI Li, Zhenhao;Zhu, Lin;Chen, Jian-Feng;Cheng, Daojian
    Enhanced Ethylene Oxide Selectivity by Cu and Re Dual-Promoted Ag Catalysts[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2018-03-28
  • 88. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian
    Enhanced photochemical performance of hexagonal WO3 by metal-assisted S-O coupling for solar-driven water splitting[期刊论文]，SCIENCE CHINA-MATERIALS，2018-01-01
  • 89. DOI Xu, Haoxiang;Xu, Cong-Qiao;Cheng, Daojian;Li, Jun
    Identification of activity trends for CO oxidation on supported transition-metal single-atom catalysts[期刊论文]，CATALYSIS SCIENCE & TECHNOLOGY，2017-12-21
  • 90. DOI Ren, Dongmei;Cheng, Gang;Li, Jianwei;Li, Jinbing;Dai, Wujun;Sun, XinXin;Cheng, Daojian
    Effect of Rhenium Loading Sequence on Selectivity of Ag-Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-12-01
  • 91. DOI Huang, Xingkai;Wu, Dengfeng;Cheng, Daojian
    Porous Co2P nanowires as high efficient bifunctional catalysts for 4-nitrophenol reduction and sodium borohydride hydrolysis[期刊论文]，JOURNAL OF COLLOID AND INTERFACE SCIENCE，2017-12-01
  • 92. DOI Ren, Dongmei;Xu, Haoxiang;Li, Jianwei;Li, Jinhing;Cheng, Daojian
    Origin of enhanced ethylene oxide selectivity by Cs-promoted silver catalyst[期刊论文]，MOLECULAR CATALYSIS，2017-11-01
  • 93. DOI Wei, Yongsheng;Huang, Xingkai;Wang, Junyan;Yu, Haiyan;Zhao, Xinsheng;Cheng, Daojian
    Synthesis of bifunctional non-noble monolithic catalyst Co-W-P/carbon cloth for sodium borohydride hydrolysis and reduction of 4-nitrophenol[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2017-10-12
  • 94. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 95. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 96. DOI Yan, Bailu;Zhao, Zheng;Zhou, Yingcheng;Yuan, Wenyan;Li, Jian;Wu, Jun;Cheng, Daojian
    A particle swarm optimization algorithm with random learning mechanism and Levy flight for optimization of atomic clusters[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2017-10-01
  • 97. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 98. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 99. DOI Yang, Yang;Dai, Changqing;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    A full understanding of oxygen reduction reaction mechanism on Au(111) surface[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2017-09-13
  • 100. DOI Shan, Aixian;Chen, Chinping;Zhang, Wei;Cheng, Daojian;Shen, Xi;Yu, Richeng;Wang, Rongming
    Giant enhancement and anomalous temperature dependence of magnetism in monodispersed NiPt2 nanoparticles[期刊论文]，NANO RESEARCH，2017-09-01
  • 101. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 102. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 103. DOI Zhang, Xing;Wu, Dengfeng;Cheng, Daojian
    Component-dependent electrocatalytic activity of PdCu bimetallic nanoparticles for hydrogen evolution reaction[期刊论文]，ELECTROCHIMICA ACTA，2017-08-20
  • 104. DOI Zhao, Zheng;Wang, Fang-Hui;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Phase stability and segregation behavior of nickel-based nanoalloys based on theory and simulation[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2017-06-25
  • 105. DOI Wu, Dengfeng;Zhang, Wei;Cheng, Daojian
    Facile Synthesis of Cu/NiCu Electrocatalysts Integrating Alloy, Core Shell, and One-Dimensional Structures for Efficient Methanol Oxidation Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2017-06-14
  • 106. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 107. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 108. DOI Zhang, Wei;Shan, Shiyao;Luo, Jin;Fisher, Adrian;Chen, Jian-Feng;Zhong, Chuan-Jian;Zhu, Jiqin;Chen, Daojian
    Origin of Enhanced Activities for CO Oxidation and O-2 Reaction over Composition-Optimized Pd50Cu50 Nanoalloy Catalysts[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2017-05-25
  • 109. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin;Cheng, Daojian
    Mechanistic insight into the facet-dependent selectivity of ethylene epoxidation on Ag nanocatalysts[期刊论文]，APPLIED CATALYSIS A: GENERAL，2017-05-25
  • 110. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin
    Ni (111)-supported graphene as a potential catalyst for high-efficient CO oxidation[期刊论文]，CARBON，2017-05-01
  • 111. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi
    Design of High-Performance Pd-Based Alloy Nanocatalysts for Direct Synthesis of H2O2[期刊论文]，ACS CATALYSIS，2017-03-01
  • 112. DOI Yu, Haiyan;Cao, Dapeng;Fisher, Adrian;Johnston, Roy L.;Cheng, Daojian
    Size effect on the adsorption and dissociation of CO2 on Co nanoclusters[期刊论文]，APPLIED SURFACE SCIENCE，2017-02-28
  • 113. DOI Lian, Xiaojun;Zhao, Zheng;Cheng, Daojian
    Recent progress on triphenylamine materials: synthesis, properties, and applications[期刊论文]，MOLECULAR CRYSTALS AND LIQUID CRYSTALS，2017-01-01
  • 114. DOI Wu, Dengfeng;Xu, Haoxiang;Cao, Dapeng;Fisher, Adrian;Gao, Yi;Cheng, Daojian
    PdCu alloy nanoparticle-decorated copper nanotubes as enhanced electrocatalysts: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-12-09
  • 115. DOI Dai, Changqing;Yang, Yang;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Interaction of CO2 with metal cluster-functionalized ionic liquids[期刊论文]，JOURNAL OF CO2 UTILIZATION，2016-12-01
  • 116. DOI Wei, Chengcheng;Zhao, Zheng;Fisher, Adrian;Zhu, Jiqin;Cheng, Daojian
    Theoretical Study on the Structures and Thermal Properties of Ag-Pt-Ni Trimetallic Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-11-01
  • 117. DOI Cheng, Daojian;Wu, Dengfeng;Xu, Haoxiang;Fisher, Adrian
    Composition-controlled Synthesis of PtCuNPs Shells on Copper Nanowires as Electrocatalysts[期刊论文]，CHEMISTRYSELECT，2016-09-16
  • 118. DOI Yu, Haiyan;Fisher, Adrian;Cheng, Daojian;Cao, Dapeng
    Cu,N-codoped Hierarchical Porous Carbons as Electrocatalysts for Oxygen Reduction Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2016-08-24
  • 119. DOI Yang, Yang;Dai, Changqing;Shen, Yanchun;Fisher, Adrian;Cheng, Daojian
    Design of binary and ternary platinum shelled electrocatalysts with inexpensive metals for the oxygen reduction reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2016-08-10
  • 120. DOI Liu, Xinyue;Dai, Changqing;Wu, Dengfeng;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Facile Synthesis of PdAgCo Trimetallic Nanoparticles for Formic Acid Electrochemical Oxidation[期刊论文]，CHEMISTRY LETTERS，2016-07-05
  • 121. DOI 程道建
    双金属纳米电催化:理论和实验研究[会议论文]，中国化学会第30届学术年会摘要集-第二十九分会：电化学材料，2016-07-01
  • 122. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    A density functional theory study of sulfur adsorption on Ag-Au nanoalloys[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2016-06-01
  • 123. DOI 程道建
    双金属纳米催化:理论和实验研究[会议论文]，第七届全国物理无机化学学术会议论文集，2016-05-06
  • 124. DOI Zhao, Zheng;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Magnetic Properties of Pt-Based Nanoalloys: A Critical Review[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-05-01
  • 125. DOI Zhao, Zheng;Fisher, Adrian;Cheng, Daojian
    Phase diagram and segregation of Ag-Co nanoalloys: insights from theory and simulation[期刊论文]，NANOTECHNOLOGY，2016-03-18
  • 126. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Huan, Haifeng;Cao, Dapeng
    Enhanced near-infrared shielding ability of (Li, K)-codoped WO3 for smart windows: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-02-09
  • 127. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Highly sensitive and selective colorimetric detection of sulphide using Ag-Au nanoalloys: a DFT study[期刊论文]，RSC ADVANCES，2016-01-01
  • 128. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文]，MOLECULAR SIMULATION，2016-01-01
  • 129. DOI Chang, Le;Liu, Zhiping;Cheng, Daojian
    Optical properties of Ag-Au nanoclusters for sulphide sensing from TDDFT calculations[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2015-12-25
  • 130. DOI Zhang, Wei;Cui, Rong;Wu, Hao;Zhu, Jiqin;Cheng, Daojian
    CO oxidation mechanism on a MgO(100) supported PtxAu3-x clusters[期刊论文]，APPLIED SURFACE SCIENCE，2015-11-30
  • 131. DOI Zhang, Wei;Sumer, Aslihan;Jellinek, Julius;Cheng, Daojian
    Morphology Tailoring of Pt Nanocatalysts for the Oxygen Reduction Reaction: The Paradigm of Pt-13[期刊论文]，CHEMNANOMAT，2015-11-01
  • 132. DOI Wu, Dengfeng;Cheng, Daojian
    Core/shell AgNi/PtAgNi nanoparticles as methanol-tolerant oxygen reduction electrocatalysts[期刊论文]，ELECTROCHIMICA ACTA，2015-10-20
  • 133. DOI wang,qian,fang,yu,孟洪,毋伟,初广文,邹海魁,程道建,陈建峰
    Enhanced simulated sunlight induced photocatalytic activity by pomegranate-like S doped SnO2@TiO2 spheres[期刊论文]，Colloids and Surfaces A: Physicochemical and Engineering Aspects，2015-10-05
  • 134. DOI Niu, Mang;Tan, Huaqiao;Cheng, Daojian;Sun, Zaicheng;Cao, Dapeng
    Bandgap engineering of Magnei phase TinO2n-1: Electron-hole self-compensation[期刊论文]，JOURNAL OF CHEMICAL PHYSICS，2015-08-07
  • 135. DOI Wu, Dengfeng;Dai, Changqing;Li, Shaojie;Cheng, Daojian
    Shape-controlled Synthesis of PdCu Nanocrystals for Formic Acid Oxidation[期刊论文]，CHEMISTRY LETTERS，2015-08-05
  • 136. DOI Niu, Mang;Cui, Rong;Wu, Hao;Cheng, Daojian;Cao, Dapeng
    Enhancement Mechanism of the Conversion Effficiency of Dye-Sensitized Solar Sells Based on Nitrogen-, Fluorine-, and Iodine-Doped TiO2 Photoanodes[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-06-18
  • 137. DOI Yang, Yang;Zhao, Zheng;Cui, Rong;Wu, Hao;Cheng, Daojian
    Structures, Thermal Stability, and Chemical Activity of Crown-Jewel-Structured Pd-Pt Nanoalloys[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-05-21
  • 138. DOI Wang, Jian;Yuan, Wenyan;Cheng, Daojian
    Hybrid genetic-particle swarm algorithm: An efficient method for fast optimization of atomic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2015-05-01
  • 139. DOI Xu, Haoxiang;Cheng, Daojian
    Effect of the Passivating Ligands on the Geometric and Electronic Properties of Au-Pd Nanoalloys[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2015-05-01
  • 140. DOI Chen, Bing;Cheng, Daojian;Zhu, Jiqin
    Synthesis of PtCu nanowires in nonaqueous solvent with enhanced activity and stability for oxygen reduction reaction[期刊论文]，JOURNAL OF POWER SOURCES，2014-12-01
  • 141. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Cao, Dapeng
    Design of the Alkali-Metal-Doped WO3 as a Near-Infrared Shielding Material for Smart Window[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2014-11-19
  • 142. DOI Li, Shaojie;Cheng, Daojian;Qiu, Xiangguo;Cao, Dapeng
    Synthesis of Cu@Pd core-shell nanowires with enhanced activity and stability for formic acid oxidation[期刊论文]，ELECTROCHIMICA ACTA，2014-10-10
  • 143. DOI Chang, Le;Xu, Haoxiang;Cheng, Daojian
    Role of ligand type on the geometric and electronic properties of Ag-Au bimetallic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2014-10-01
  • 144. DOI Zhao, Zheng;Li, Mingjiang;Cheng, Daojian;Zhu, Jiqin
    Understanding the structural properties and thermal stabilities of Au-Pd-Pt trimetallic clustersle[期刊论文]，CHEMICAL PHYSICS，2014-09-30
  • 145. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Fluorite TiO2(111) Surface Phase for Enhanced Visible-Light Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-09-04
  • 146. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    SiH/TiO2 and GeH/TiO2 Heterojunctions: Promising TiO2-based Photocatalysts under Visible Light[期刊论文]，SCIENTIFIC REPORTS，2014-05-02
  • 147. DOI Cheng, Daojian;Xu, Haoxiang;Fortunelli, Alessandro
    Tuning the catalytic activity of Au-Pd nanoalloys in CO oxidation via composition[期刊论文]，JOURNAL OF CATALYSIS，2014-05-01
  • 148. DOI Fang, Yu;Cheng, Daojian;Wu, Wei
    Understanding electronic and optical properties of N-Sn codoped anatase TiO2[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-04-01
  • 149. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding the Mechanism of Photocatalysis Enhancements in the Graphene-like Semiconductor Sheet/TiO2 Composites[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-03-20
  • 150. DOI Cheng, Daojian;Zhang, Minming;Chen, Jianfeng;Yang, Chenxi;Zeng, Xiaofei;Cao, Dapeng
    Computer Screening of Dopants for the Development of New SnO2-Based Transparent Conducting Oxides[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-30
  • 151. DOI Yang, Yang;Cheng, Daojian
    Role of Composition and Geometric Relaxation in CO2 Binding to Cu-Ni Bimetallic Clusters[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-09
  • 152. DOI Zhang, Wei;Cheng, Daojian;Zhu, Jiqin
    Theoretical study of CO catalytic oxidation on free and defective graphene-supported Au-Pd bimetallic clusters[期刊论文]，RSC ADVANCES，2014-01-01
  • 153. DOI Cheng, Daojian;Qiu, Xiangguo;Yu, Haiyan
    Enhancing oxygen reduction reaction activity of Pt-shelled catalysts via subsurface alloying[期刊论文]，PHYSICAL CHEMISTRY CHEMICAL PHYSICS，2014-01-01
  • 154. DOI Tan, Huaqiao;Zhao, Zhao;Niu, Mang;Mao, Chengyu;Cao, Dapeng;Cheng, Daojian;Feng, Pingyun;Sun, Zaicheng
    A facile and versatile method for preparation of colored TiO2 with enhanced solar-driven photocatalytic activity[期刊论文]，NANOSCALE，2014-01-01
  • 155. DOI Li, Mingjiang;Li, Shaojie;Cheng, Daojian
    Influence of adsorbates on the segregation properties of Au-Pd bimetallic clusters[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-01-01
  • 156. DOI Li, Mingjiang;Cheng, Daojian
    Molecular Dynamics Simulation of the Melting Behavior of Crown-Jewel Structured Au-Pd Nanoalloys[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-09-12
  • 157. DOI Cheng, Daojian;Yuan, Shuai;Ferrando, Riccardo
    Structure, chemical ordering and thermal stability of Pt-Ni alloy nanoclusters[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2013-09-04
  • 158. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding Photoelectrochennical Properties of B-N Codoped Anatase TiO2 for Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-08-08
  • 159. DOI Cheng, Daojian;Negreiros, Fabio R.;Apra, Edoardo;Fortunelli, Alessandro
    Computational Approaches to the Chemical Conversion of Carbon Dioxide[期刊论文]，CHEMSUSCHEM，2013-06-01
  • 160. DOI Fang, Yu;Cheng, Daojian;Niu, Mang;Yi, Yongjun;Wu, Wei
    Tailoring the electronic and optical properties of rutile TiO2 by (Nb + Sb, C) codoping from DFT plus U calculations[期刊论文]，CHEMICAL PHYSICS LETTERS，2013-04-19
  • 161. DOI Cheng, Daojian;Cao, Dapeng;Wang, Wenchuan
    Hydrogen storage in porous materials and nanoalloys as catalysts for fuel cell application by using multiscale simulation and experimental methods[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2013-04-07
  • 162. DOI Cheng, Daojian;Jiang, Kun
    Structural stability and kinetics of small carbon clusters on a bimetallic Cu/Ni(111) surface: A first-principles study[期刊论文]，SURFACE SCIENCE，2013-03-01
  • 163. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Enhanced photoelectrochemical performance of anatase TiO2 by metal-assisted S-O coupling for water splitting[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2013-02-06
[+][-] 2026年
  • 1. DOI Zhang, Huimin;Liu, Wenhao;Li, Zhenhao;Qiao, Liang;Chi, Kebin;Guo, Xiaoyan;Cao, Dong;Cheng, Daojian
    Constructing CoP/Ni2P Heterostructure Confined Ru Sub-Nanoclusters for Enhanced Water Splitting in Wide pH Conditions[期刊论文]，Advanced Science，2024-09-18
  • 2. DOI Cao, Dong;Zhang, Zhirong;Cui, Yahui;Zhang, Runhao;Zhang, Lipeng;Zeng, Jie;Cheng, Daojian
    One-Step Approach for Constructing High-Density Single-Atom Catalysts toward Overall Water Splitting at Industrial Current Densities[期刊论文]，Angewandte Chemie-International Edition，2023-02-20
  • 3. DOI Sun, Jindong;Xu, Haoxiang;Ma, Haowen;Zhan, Xuecheng;Zhu, Jiqin;Cheng, Daojian
    Isoprene selective hydrogenation using AgCu-promoted Pd nanoalloys[期刊论文]，FARADAY DISCUSSIONS，2023-01-31
  • 4. DOI Liu, Tianpeng;Liu, Wenhao;Ma, Mengyao;Guo, Linke;Cui, Rong;Cheng, Daojian;Cao, Dong
    Constructing nickel vanadium phosphide nanoarrays with highly active heterointerfaces for water oxidation in alkali media[期刊论文]，ELECTROCHIMICA ACTA，2023-01-20
  • 5. DOI Cao, Dong;Huang, Xiaoyu;Zhang, Huimin;Liu, Wenhao;Cheng, Daojian
    Constructing porous RuCu nanotubes with highly efficient alloy phase for water splitting in different pH conditions[期刊论文]，Chemical Engineering Journal，2023-01-15
  • 6. DOI Wang, Jiayi;Xu, Haoxiang;Che, Chunxia;Zhu, Jiqin;Cheng, Daojian
    Rational Design of PdAg Catalysts for Acetylene Selective Hydrogenation via Structural Descriptor-based Screening Strategy[期刊论文]，ACS Catalysis，2023-01-06
  • 7. DOI Zhang, Huimin;Guo, Xiaoyan;Liu, Wenhao;Wu, Dengfeng;Cao, Dong;Cheng, Daojian
    Regulating surface composition of platinum-copper nanotubes for enhanced hydrogen evolution reaction in all pH values[期刊论文]，Journal of Colloid and Interface Science，2023-01-01
  • 8. DOI Cao, Dong;Shao, Jie;Cui, Yahui;Zhang, Lipeng;Cheng, Daojian
    Interfacial Engineering of Copper–Nickel Selenide Nanodendrites for Enhanced Overall Water Splitting in Alkali Condition[期刊论文]，Small，2023-01-01
  • 9. DOI Wang, Xuning;Xu, Haoxiang;Luo, Yibin;Cheng, Daojian
    High Selective Direct Synthesis of H2O2 over Pd-1@gamma-Al2O3 Single-Atom Catalyst[期刊论文]，CHEMCATCHEM，2022-11-08
  • 10. DOI Deng, Zhuoran;Zhao, Liqiang;Cheng, Daojian
    A high-throughput catalyst synthesis system for Ag-based catalysts[期刊论文]，Review of Scientific Instruments，2022-11-01
  • 11. DOI Xu, Xiaopei;Peng, Zhipeng;Xu, Haoxiang;Cheng, Daojian
    Computational screening of nonmetal dopants to active MoS2 basal-plane for hydrogen evolution reaction via structural descriptor[期刊论文]，Journal of Catalysis，2022-10-31
  • 12. DOI 曹东,许昊翔,Hongliang Li,Chen Feng,Jie Zeng,程道建
    Volcano-type relationship between oxidation states and catalytic activity of single-atom catalysts towards hydrogen evolution[期刊论文]，Nature Communications，2022-10-04
  • 13. DOI Yan, Jingjing;Xu, Haoxiang;Chang, Le;Lin, Aijun;Cheng, Daojian
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single-atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 14. DOI 燕晶晶,许昊翔,常乐,林爱军,程道建
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 15. DOI Cheng, Feipeng;Cheng, Jihao;Nan, Yang;Xie, Yuan;Yang, Tongqian;Cheng, Daojian;Zhu, Jiqin;Xu, Haoxiang
    Enhancing oxidative hydration of ethylene towards ethylene glycol over metal-modified titanosilicate catalysts[期刊论文]，Applied Catalysis A: General，2022-08-05
  • 16. DOI Wen, Qi-Xing;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Design of CuCs-doped Ag-based catalyst for ethylene epoxidation[期刊论文]，Chinese Journal of Chemical Physics，2022-08-01
  • 17. DOI 张眉佳,许昊翔,罗一斌,朱吉钦,程道建
    Enhancing the catalytic performance of PdAu catalysts by W induced strong interaction for the direct synthesis of H2O2[期刊论文]，Catalysis Science & Technology，2022-07-26
  • 18. DOI Deng, Zhuoran;Zhou, Yingcheng;Zhao, Liqiang;Cheng, Daojian
    Structures and structural evolution of M-N (M = Pt, Ag, Au, N=2-20) from combined revised particle swarm optimization and density function theory[期刊论文]，MOLECULAR SIMULATION，2022-07-03
  • 19. DOI Zhang, Huimin;Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Carbon-based material-supported single-atom catalysts for energy conversion[期刊论文]，ISCIENCE，2022-06-17
  • 20. DOI 陈志强;车春霞;吴登峰;温翯;韩伟;张峰;许昊翔;程道建
    乙炔选择性加氢催化剂研究进展[期刊论文]，化工进展，2022-03-17
  • 21. DOI Liu, Ning;Cao, Dong;Liu, Wenhao;Zhang, Huimin;Zhu, Yinhai;Chang, Le;Wu, Dengfeng;Cheng, Daojian
    Constructing La-doped ultrathin Co-based nanostructured electrocatalysts for high-performance water oxidation process[期刊论文]，International Journal of Hydrogen Energy，2022-01-01
  • 22. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Branch-leaf-shaped CuNi@NiFeCu nanodendrites as highly efficient electrocatalysts for overall water splitting[期刊论文]，Applied Catalysis B-Environmental，2021-12-05
  • 23. DOI Zhang, Meijia;Luo, Yibin;Wu, Dengfeng;Li, Qian;Xu, Haoxiang;Cheng, Daojian
    Promoter role of tungsten in W-Pd/Al2O3 catalyst for direct synthesis of H2O2: Modification of Pd/PdO ratio[期刊论文]，APPLIED CATALYSIS A-GENERAL，2021-11-25
  • 24. DOI 孙晋冬;展学成;吴登峰;谢元;马好文;许昊翔;程道建
    碳四炔烃选择性加氢催化剂研究进展[期刊论文]，石油学报(石油加工)，2021-10-15
  • 25. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Construction of Dual-Site Atomically Dispersed Electrocatalysts with Ru-C-5 Single Atoms and Ru-O-4 Nanoclusters for Accelerated Alkali Hydrogen Evolution[期刊论文]，Small，2021-08-01
  • 26. DOI Cao, Dong;Wang, Jiayi;Zhang, Huimin;Xu, Haoxiang;Cheng, Daojian
    Growth of IrCu nanoislands with rich IrCu/Ir interfaces enables highly efficient overall water splitting in non-acidic electrolytes[期刊论文]，Chemical Engineering Journal，2021-07-15
  • 27. DOI Zhu, Yinhai;Cao, Dong;Liu, Ning;Cheng, Daojian
    One-step synthesis of atomic Ru doped ultra-thin Co(OH)(2) nanosheets for oxygen evolution reaction in different pH values[期刊论文]，International Journal of Hydrogen Energy，2021-06-28
  • 28. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Metal Dopants in Enhancing the Selectivity of Ag-Catalyzed Ethylene Epoxidation: Optimizing Oxophilicity of Reaction Site via Cocatalytic Mechanism[期刊论文]，ACS Catalysis，2021-03-19
  • 29. DOI 吴建国;吴登峰;程道建
    丙烷脱氢制丙烯用单原子催化剂研究进展[期刊论文]，化工进展，2021-03-16
  • 30. DOI Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Review on Synthesis and Catalytic Coupling Mechanism of Highly Active Electrocatalysts for Water Splitting[期刊论文]，Energy Technology，2021-02-01
  • 31. DOI Ma, Haowen;Xu, Xiaopei;Xu, Haoxiang;Feng, Huixia;Xie, Yuan;Cheng, Daojian
    Understanding composition-dependent catalytic performance of PdAg for the hydrogenation of 1,3-butadiene to 1-butene[期刊论文]，CATALYSIS COMMUNICATIONS，2021-01-15
  • 32. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文]，Advances in Physics-X，2021-01-01
  • 33. DOI Huang, Xingkai;Xu, Haoxiang;Cao, Dong;Cheng, Daojian
    Interface construction of P-Substituted MoS2 as efficient and robust electrocatalyst for alkaline hydrogen evolution reaction[期刊论文]，Nano Energy，2020-12-01
  • 34. DOI Yang, Liu,许昊翔,Liu, Huibing,曾晓飞,程道建,黄燕,Zheng, Lirong,Cao, Rui,曹达鹏
    Oxygen-Reconstituted Active Species of Single-Atom Cu Catalysts for Oxygen Reduction Reaction[期刊论文]，Research，2020-10-05
  • 35. DOI Xu, Xiaopei,许昊翔,程道建
    Identification of the Anti-triangular Etched MoS2 with Comparative Activity with Commercial Pt for Hydrogen Evolution Reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-10-04
  • 36. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Growth of Highly Active Amorphous RuCu Nanosheets on Cu Nanotubes for the Hydrogen Evolution Reaction in Wide pH Values[期刊论文]，Small，2020-09-01
  • 37. DOI 许昊翔,程道建
    First-principles-aided Thermodynamic Modeling of Transition-metal Heterogeneous Catalysts: A review.[期刊论文]，Green Energy & Environment，2020-07-14
  • 38. DOI Xu, Haoxiang;Cheng, Daojian
    First-principles-aided thermodynamic modeling of transition-metal heterogeneous catalysts: A review[期刊论文]，GREEN ENERGY & ENVIRONMENT，2020-07-01
  • 39. DOI Che, Chunxia;Xu, Haoxiang;Wen, He;Gou, Galian;Cheng, Daojian
    Theoretical Study on the Structural, Thermal and Phase Stability of Pt-Cu Alloy Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2020-05-01
  • 40. DOI Zhang, Wei;Zhu, Jiqin;Cheng, Daojian;Zeng, Xiao Cheng
    PtCoNi Alloy Nanoclusters for Synergistic Catalytic Oxygen Reduction Reaction[期刊论文]，ACS APPLIED NANO MATERIALS，2020-03-01
  • 41. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Construction of Defect-Rich RhCu Nanotubes with Highly Active Rh3Cu1 Alloy Phase for Overall Water Splitting in All pH Values[期刊论文]，ADVANCED ENERGY MATERIALS，2020-03-01
  • 42. DOI Wu, Dengfeng;Zhang, Wei;Lin, Aijun;Cheng, Daojian
    Low Pt-Content Ternary PtNiCu Nanoparticles with Hollow Interiors and Accessible Surfaces as Enhanced Multifunctional Electrocatalysts[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2020-02-26
  • 43. DOI Wu, Dengfeng;Yang, Yang;Dai, Changqing;Cheng, Daojian
    Enhanced oxygen reduction activity of PtCu nanoparticles by morphology tuning and transition-metal doping[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-02-07
  • 44. DOI Huang, Xingkai;Xu, Xiaopei;Luan, Xiaoxu;Cheng, Daojian
    CoP nanowires coupled with CoMoP nanosheets as a highly efficient cooperative catalyst for hydrogen evolution reaction[期刊论文]，NANO ENERGY，2020-02-01
  • 45. DOI Zhou, Yingcheng;Zhao, Zheng;Cheng, Daojian
    Cluster structure prediction via revised particle-swarm optimization algorithm[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2020-02-01
  • 46. DOI Li, Lin-Xin;Xie, Zhi-Hui;Fernandez, Carlos;Wu, Liang;Cheng, Daojian;Jiang, Xiao-Hui;Zhong, Chuan-Jian
    Development of a thiophene derivative modified LDH coating for Mg alloy corrosion protection[期刊论文]，ELECTROCHIMICA ACTA，2020-01-10
  • 47. DOI Zhang, Junmeng;Xu, Xiaopei;Yang, Liu;Cheng, Daojian;Cao, Dapeng
    Single-Atom Ru Doping Induced Phase Transition of MoS2 and S Vacancy for Hydrogen Evolution Reaction[期刊论文]，SMALL METHODS，2019-12-11
  • 48. DOI Zhao, Zheng,许昊翔,Feng, Zongyu,Zhang, Yongqi,Cui, Meisheng,曹达鹏,程道建
    Design of High-Performance Co-Based Alloy Nanocatalysts for the Oxygen Reduction Reaction[期刊论文]，Chemistry - A European Journal，2019-12-03
  • 49. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Chlorine in Selectivity Enhancement of Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-11-27
  • 50. DOI Xu, Xiaopei;Xu, Haoxiang;Cheng, Daojian
    Design of high-performance MoS2 edge supported single-metal atom bifunctional catalysts for overall water splitting via a simple equation[期刊论文]，NANOSCALE，2019-11-14
  • 51. DOI Wu, Dengfeng;Cheng, Daojian
    Structure-controlled synthesis of one-dimensional PdCu nanoscatalysts via a seed-mediated approach for oxygen reduction reaction[期刊论文]，APPLIED SURFACE SCIENCE，2019-11-01
  • 52. DOI Huang, Xiaoyu;Yang, Yang;Cheng, Daojian
    Hydrogen generation from formic acid decomposition on Pd-Cu nanoalloys[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-09-13
  • 53. DOI Zhang, Wei;Deibert, David L.;Cheng, Daojian;Zeng, Xiao Cheng
    Magnetism in bimetallic PtxNiN-x clusters via cross-atomic coupling[期刊论文]，JOURNAL OF MATERIALS CHEMISTRY C，2019-08-14
  • 54. DOI Ma, Haowen;Yang, Yang;Feng, Huixia;Cheng, Daojian
    DFT Study of Pyrolysis Gasoline Hydrogenation on Pd(100), Pd(110) and Pd(111) Surfaces[期刊论文]，CATALYSIS LETTERS，2019-08-01
  • 55. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Fortunelli, Alessandro;Cheng, Daojian
    Selectivity-Driven Design of the Ag-Cu Alloys for the Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-07-24
  • 56. DOI Cao, Dong;Cheng, Daojian
    One-pot synthesis of copper-nickel sulfide nanowires for overall water splitting in alkaline media[期刊论文]，CHEMICAL COMMUNICATIONS，2019-07-18
  • 57. DOI Huang, Xingkai;Xu, Xiaopei;Li, Chao;Wu, Dengfeng;Cheng, Daojian;Cao, Dapeng
    Vertical CoP Nanoarray Wrapped by N,P-Doped Carbon for Hydrogen Evolution Reaction in Both Acidic and Alkaline Conditions[期刊论文]，ADVANCED ENERGY MATERIALS，2019-06-01
  • 58. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Cheng, Daojian
    The synergistic effect between crystal planes and promoters on Ag-catalyzed ethylene epoxidation[期刊论文]，APPLIED SURFACE SCIENCE，2019-05-15
  • 59. DOI Yang, Liu;Xu, Haoxiang;Liu, Huibing;Cheng, Daojian;Cao, Dapeng
    Active Site Identification and Evaluation Criteria of In Situ Grown CoTe and NiTe Nanoarrays for Hydrogen Evolution and Oxygen Evolution Reactions[期刊论文]，SMALL METHODS，2019-05-10
  • 60. DOI Yang, Chenxi;Wang, Guoqing;Liang, Aimin;Yue, Yi;Peng, Hui;Cheng, Daojian
    Understanding the role of Au in the selective hydrogenation of acetylene on trimetallic PdAgAu catalytic surface[期刊论文]，CATALYSIS COMMUNICATIONS，2019-05-05
  • 61. DOI Li, Pengcheng;Wu, Dengfeng;Dai, Changqing;Huang, Xingkai;Li, Chao;Yin, Zhen;Zhou, Song;Lv, Zhengang;Cheng, Daojian;Zhu, Jiqin;Xu, Jian;Liu, Xi
    Controlled Synthesis of Copper-Doped Molybdenum Carbide Catalyst with Enhanced Activity and Stability for Hydrogen Evolution Reaction[期刊论文]，CATALYSIS LETTERS，2019-05-01
  • 62. DOI Elouarzaki Kamal,Wang Yian,Kannan Vishvak,许昊翔,程道建,Lee Jong-Min,Fisher Adrian C.
    Hydrogenase-Like Electrocatalytic Activation and Inactivation Mechanism by Three-Dimensional Binderless Molecular Catalyst[期刊论文]，ACS Applied Energy Materials，2019-04-09
  • 63. DOI Xu, Haoxiang;Cheng, Daojian
    Rational design of transition metal nanocatalyst by structure descriptor[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2019-03-31
  • 64. DOI Yang, Mengjie;Wu, Dengfeng;Cheng, Daojian
    Biomass-derived porous carbon supported Co-CoO yolk-shell nanoparticles as enhanced multifunctional electrocatalysts[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-03-08
  • 65. DOI Zhao, Zheng;Kong, Kewei;Wang, Shixian;Zhou, Yingcheng;Cheng, Daojian;Wang, Wenchuan;Zeng, Xiao Cheng;Li, Hui
    Understanding Hygroscopic Nucleation of Sulfate Aerosols: Combination of Molecular Dynamics Simulation with Classical Nucleation Theory[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY LETTERS，2019-03-07
  • 66. DOI Lv, Yanlong,朱琳,许昊翔,Yang, Liu,刘志平,程道建,Cao, Xiaohua,Yun Jimmy,曹达鹏
    Core/shell Template-derived Co, N-doped Carbon Bifunctional Electrocatalysts for Rechargeable Zn-air Battery[期刊论文]，Engineered Science，2019-02-28
  • 67. DOI Zhao, Zheng;Xu, Haoxiang;Gao, Yi;Cheng, Daojian
    Universal description of heating-induced reshaping preference of core-shell bimetallic nanoparticles[期刊论文]，NANOSCALE，2019-01-21
  • 68. DOI Yang, Yang,Zhao, Zheng,程道建,朱吉钦
    Effect of Size and Composition on the Structural Stability of Pt–Ni Nanoalloys[期刊论文]，Journal of Cluster Science，2019-01-14
  • 69. DOI Nan, Yang;Wang, Yinuo;Cao, Dong;Yang, Yang;Cheng, Daojian
    Adsorption and dissociation of borohydride on different Ir-Ni alloy surfaces[期刊论文]，Appl Surf Sci，2019-01-01
  • 70. DOI Yang, Yang,许昊翔,曹达鹏,曾晓成,程道建
    Hydrogen Production via Efficient Formic Acid Decomposition: Engineering the Surface Structure of Pd-Based Alloy Catalysts by Design[期刊论文]，ACS Catalysis，2018-12-07
  • 71. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Zhu, Jiqin;Cheng, Daojian
    Facet-dependent diffusion of atomic oxygen on Ag surfaces[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2018-12-01
  • 72. DOI Chang, Le;Cheng, Daojian;Sementa, Luca;Fortunelli, Alessandro
    Hydrogen evolution reaction (HER) on Au@Ag ultrananoclusters as electro-catalysts[期刊论文]，NANOSCALE，2018-10-07
  • 73. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi;Zeng, Xiao Cheng
    Assessment of Catalytic Activities of Gold Nanoclusters with Simple Structure Descriptors[期刊论文]，ACS CATALYSIS，2018-10-01
  • 74. DOI Yang, Yang;Dai, Changqing;Wu, Dengfeng;Liu, Zhiping;Cheng, Daojian
    The Size Effect of PdCu Bimetallic Nanoparticles on Oxygen Reduction Reaction Activity[期刊论文]，CHEMELECTROCHEM，2018-09-12
  • 75. DOI Lian, Xiaojun;Niu, Mang;Huang, Yan;Cheng, Daojian
    MoS2-CdS heterojunction with enhanced photocatalytic activity: A first principles study[期刊论文]，JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS，2018-09-01
  • 76. DOI Huang, Yichao;Hu, Jun;Xu, Haoxiang;Bian, Wei;Ge, Jingxuan;Zang, Dejin;Cheng, Daojian;Lv, Yaokang;Zhang, Cheng;Gu, Jing;Wei, Yongge
    Fine Tuning Electronic Structure of Catalysts through Atomic Engineering for Enhanced Hydrogen Evolution[期刊论文]，ADVANCED ENERGY MATERIALS，2018-08-27
  • 77. DOI Miao, Xue-Pei;Cheng, Dao-Jian;Dai, Ya-Dong;Meng, Yan;Li, Xiao-Yu
    Origin of Modulus Improvement for Epoxide-terminated Hyperbranched Poly(ether sulphone)/DGEBA/TETA Systems[期刊论文]，CHINESE JOURNAL OF POLYMER SCIENCE，2018-08-01
  • 78. DOI Chang, Le;Baseggio, Oscar;Sernenta, Luca;Cheng, Daojian;Fronzoni, Giovanna;Toffoli, Daniele;Apra, Edoardo;Stener, Mauro;Fortunelli, Alessandro
    Individual Component Map of Rotatory Strength and Rotatory Strength Density Plots As Analysis Tools of Circular Dichroism Spectra of Complex Systems[期刊论文]，JOURNAL OF CHEMICAL THEORY AND COMPUTATION，2018-07-01
  • 79. DOI Elouarzaki, Kamal;Cheng, Daojian;Fisher, Adrian C.;Lee, Jong-Min
    Coupling orientation and mediation strategies for efficient electron transfer in hybrid biofuel cells[期刊论文]，NATURE ENERGY，2018-07-01
  • 80. DOI Wang, Zegao;Li, Qiang;Xu, Haoxiang;Dahl-Petersen, Christian;Yang, Qian;Cheng, Daojian;Cao, Dapeng;Besenbacher, Flemming;Lauritsen, Jeppe V.;Helveg, Stig;Dong, Mingdong
    Controllable etching of MoS2 basal planes for enhanced hydrogen evolution through the formation of active edge sites[期刊论文]，NANO ENERGY，2018-07-01
  • 81. DOI Yang, Liu;Cheng, Daojian;Zeng, Xiaofei;Wan, Xin;Shui, Jianglan;Xiang, Zhonghua;Cao, Dapeng
    Unveiling the high-activity origin of single-atom iron catalysts for oxygen reduction reaction[期刊论文]，PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA，2018-06-26
  • 82. DOI 杨洋,Yu, Haiyan,Cai, Yushun,Ferrando, Riccardo,程道建
    Origin of enhanced stability and oxygen adsorption capacity of mediumsized Pt–Ni nanoclusters[期刊论文]，Journal of Physics: Condensed Matter，2018-06-22
  • 83. DOI Yu, Haiyan,Yang, Liu,程道建,曹达鹏
    Zeolitic-imidazolate Framework (ZIF)@ZnCo-ZIF Core-shell Template Derived Co, N-doped Carbon Catalysts for Oxygen Reduction Reaction[期刊论文]，Engineered Science，2018-06-02
  • 84. DOI 吴登峰,Zhang, Xin,朱吉钦,程道建
    Concerted Catalysis on Tanghulu-like Cu@Zeolitic Imidazolate Framework-8 (ZIF-8) Nanowires with Tuning Catalytic Performances for 4-nitrophenol Reduction[期刊论文]，Engineered Science，2018-05-21
  • 85. DOI Huang, Yan;Wu, Dengfeng;Cao, Dapeng;Cheng, Daojian
    Facile preparation of biomass-derived bifunctional electrocatalysts for oxygen reduction and evolution reactions[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2018-05-03
  • 86. DOI Xu, Haoxiang;Cheng, Daojian;Cao, Dapeng;Zeng, Xiao Cheng
    A universal principle for a rational design of single-atom electrocatalysts[期刊论文]，NATURE CATALYSIS，2018-05-01
  • 87. DOI Li, Zhenhao;Zhu, Lin;Chen, Jian-Feng;Cheng, Daojian
    Enhanced Ethylene Oxide Selectivity by Cu and Re Dual-Promoted Ag Catalysts[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2018-03-28
  • 88. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian
    Enhanced photochemical performance of hexagonal WO3 by metal-assisted S-O coupling for solar-driven water splitting[期刊论文]，SCIENCE CHINA-MATERIALS，2018-01-01
  • 89. DOI Xu, Haoxiang;Xu, Cong-Qiao;Cheng, Daojian;Li, Jun
    Identification of activity trends for CO oxidation on supported transition-metal single-atom catalysts[期刊论文]，CATALYSIS SCIENCE & TECHNOLOGY，2017-12-21
  • 90. DOI Ren, Dongmei;Cheng, Gang;Li, Jianwei;Li, Jinbing;Dai, Wujun;Sun, XinXin;Cheng, Daojian
    Effect of Rhenium Loading Sequence on Selectivity of Ag-Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-12-01
  • 91. DOI Huang, Xingkai;Wu, Dengfeng;Cheng, Daojian
    Porous Co2P nanowires as high efficient bifunctional catalysts for 4-nitrophenol reduction and sodium borohydride hydrolysis[期刊论文]，JOURNAL OF COLLOID AND INTERFACE SCIENCE，2017-12-01
  • 92. DOI Ren, Dongmei;Xu, Haoxiang;Li, Jianwei;Li, Jinhing;Cheng, Daojian
    Origin of enhanced ethylene oxide selectivity by Cs-promoted silver catalyst[期刊论文]，MOLECULAR CATALYSIS，2017-11-01
  • 93. DOI Wei, Yongsheng;Huang, Xingkai;Wang, Junyan;Yu, Haiyan;Zhao, Xinsheng;Cheng, Daojian
    Synthesis of bifunctional non-noble monolithic catalyst Co-W-P/carbon cloth for sodium borohydride hydrolysis and reduction of 4-nitrophenol[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2017-10-12
  • 94. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 95. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 96. DOI Yan, Bailu;Zhao, Zheng;Zhou, Yingcheng;Yuan, Wenyan;Li, Jian;Wu, Jun;Cheng, Daojian
    A particle swarm optimization algorithm with random learning mechanism and Levy flight for optimization of atomic clusters[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2017-10-01
  • 97. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 98. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 99. DOI Yang, Yang;Dai, Changqing;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    A full understanding of oxygen reduction reaction mechanism on Au(111) surface[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2017-09-13
  • 100. DOI Shan, Aixian;Chen, Chinping;Zhang, Wei;Cheng, Daojian;Shen, Xi;Yu, Richeng;Wang, Rongming
    Giant enhancement and anomalous temperature dependence of magnetism in monodispersed NiPt2 nanoparticles[期刊论文]，NANO RESEARCH，2017-09-01
  • 101. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 102. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 103. DOI Zhang, Xing;Wu, Dengfeng;Cheng, Daojian
    Component-dependent electrocatalytic activity of PdCu bimetallic nanoparticles for hydrogen evolution reaction[期刊论文]，ELECTROCHIMICA ACTA，2017-08-20
  • 104. DOI Zhao, Zheng;Wang, Fang-Hui;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Phase stability and segregation behavior of nickel-based nanoalloys based on theory and simulation[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2017-06-25
  • 105. DOI Wu, Dengfeng;Zhang, Wei;Cheng, Daojian
    Facile Synthesis of Cu/NiCu Electrocatalysts Integrating Alloy, Core Shell, and One-Dimensional Structures for Efficient Methanol Oxidation Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2017-06-14
  • 106. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 107. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 108. DOI Zhang, Wei;Shan, Shiyao;Luo, Jin;Fisher, Adrian;Chen, Jian-Feng;Zhong, Chuan-Jian;Zhu, Jiqin;Chen, Daojian
    Origin of Enhanced Activities for CO Oxidation and O-2 Reaction over Composition-Optimized Pd50Cu50 Nanoalloy Catalysts[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2017-05-25
  • 109. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin;Cheng, Daojian
    Mechanistic insight into the facet-dependent selectivity of ethylene epoxidation on Ag nanocatalysts[期刊论文]，APPLIED CATALYSIS A: GENERAL，2017-05-25
  • 110. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin
    Ni (111)-supported graphene as a potential catalyst for high-efficient CO oxidation[期刊论文]，CARBON，2017-05-01
  • 111. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi
    Design of High-Performance Pd-Based Alloy Nanocatalysts for Direct Synthesis of H2O2[期刊论文]，ACS CATALYSIS，2017-03-01
  • 112. DOI Yu, Haiyan;Cao, Dapeng;Fisher, Adrian;Johnston, Roy L.;Cheng, Daojian
    Size effect on the adsorption and dissociation of CO2 on Co nanoclusters[期刊论文]，APPLIED SURFACE SCIENCE，2017-02-28
  • 113. DOI Lian, Xiaojun;Zhao, Zheng;Cheng, Daojian
    Recent progress on triphenylamine materials: synthesis, properties, and applications[期刊论文]，MOLECULAR CRYSTALS AND LIQUID CRYSTALS，2017-01-01
  • 114. DOI Wu, Dengfeng;Xu, Haoxiang;Cao, Dapeng;Fisher, Adrian;Gao, Yi;Cheng, Daojian
    PdCu alloy nanoparticle-decorated copper nanotubes as enhanced electrocatalysts: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-12-09
  • 115. DOI Dai, Changqing;Yang, Yang;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Interaction of CO2 with metal cluster-functionalized ionic liquids[期刊论文]，JOURNAL OF CO2 UTILIZATION，2016-12-01
  • 116. DOI Wei, Chengcheng;Zhao, Zheng;Fisher, Adrian;Zhu, Jiqin;Cheng, Daojian
    Theoretical Study on the Structures and Thermal Properties of Ag-Pt-Ni Trimetallic Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-11-01
  • 117. DOI Cheng, Daojian;Wu, Dengfeng;Xu, Haoxiang;Fisher, Adrian
    Composition-controlled Synthesis of PtCuNPs Shells on Copper Nanowires as Electrocatalysts[期刊论文]，CHEMISTRYSELECT，2016-09-16
  • 118. DOI Yu, Haiyan;Fisher, Adrian;Cheng, Daojian;Cao, Dapeng
    Cu,N-codoped Hierarchical Porous Carbons as Electrocatalysts for Oxygen Reduction Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2016-08-24
  • 119. DOI Yang, Yang;Dai, Changqing;Shen, Yanchun;Fisher, Adrian;Cheng, Daojian
    Design of binary and ternary platinum shelled electrocatalysts with inexpensive metals for the oxygen reduction reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2016-08-10
  • 120. DOI Liu, Xinyue;Dai, Changqing;Wu, Dengfeng;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Facile Synthesis of PdAgCo Trimetallic Nanoparticles for Formic Acid Electrochemical Oxidation[期刊论文]，CHEMISTRY LETTERS，2016-07-05
  • 121. DOI 程道建
    双金属纳米电催化:理论和实验研究[会议论文]，中国化学会第30届学术年会摘要集-第二十九分会：电化学材料，2016-07-01
  • 122. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    A density functional theory study of sulfur adsorption on Ag-Au nanoalloys[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2016-06-01
  • 123. DOI 程道建
    双金属纳米催化:理论和实验研究[会议论文]，第七届全国物理无机化学学术会议论文集，2016-05-06
  • 124. DOI Zhao, Zheng;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Magnetic Properties of Pt-Based Nanoalloys: A Critical Review[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-05-01
  • 125. DOI Zhao, Zheng;Fisher, Adrian;Cheng, Daojian
    Phase diagram and segregation of Ag-Co nanoalloys: insights from theory and simulation[期刊论文]，NANOTECHNOLOGY，2016-03-18
  • 126. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Huan, Haifeng;Cao, Dapeng
    Enhanced near-infrared shielding ability of (Li, K)-codoped WO3 for smart windows: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-02-09
  • 127. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Highly sensitive and selective colorimetric detection of sulphide using Ag-Au nanoalloys: a DFT study[期刊论文]，RSC ADVANCES，2016-01-01
  • 128. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文]，MOLECULAR SIMULATION，2016-01-01
  • 129. DOI Chang, Le;Liu, Zhiping;Cheng, Daojian
    Optical properties of Ag-Au nanoclusters for sulphide sensing from TDDFT calculations[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2015-12-25
  • 130. DOI Zhang, Wei;Cui, Rong;Wu, Hao;Zhu, Jiqin;Cheng, Daojian
    CO oxidation mechanism on a MgO(100) supported PtxAu3-x clusters[期刊论文]，APPLIED SURFACE SCIENCE，2015-11-30
  • 131. DOI Zhang, Wei;Sumer, Aslihan;Jellinek, Julius;Cheng, Daojian
    Morphology Tailoring of Pt Nanocatalysts for the Oxygen Reduction Reaction: The Paradigm of Pt-13[期刊论文]，CHEMNANOMAT，2015-11-01
  • 132. DOI Wu, Dengfeng;Cheng, Daojian
    Core/shell AgNi/PtAgNi nanoparticles as methanol-tolerant oxygen reduction electrocatalysts[期刊论文]，ELECTROCHIMICA ACTA，2015-10-20
  • 133. DOI wang,qian,fang,yu,孟洪,毋伟,初广文,邹海魁,程道建,陈建峰
    Enhanced simulated sunlight induced photocatalytic activity by pomegranate-like S doped SnO2@TiO2 spheres[期刊论文]，Colloids and Surfaces A: Physicochemical and Engineering Aspects，2015-10-05
  • 134. DOI Niu, Mang;Tan, Huaqiao;Cheng, Daojian;Sun, Zaicheng;Cao, Dapeng
    Bandgap engineering of Magnei phase TinO2n-1: Electron-hole self-compensation[期刊论文]，JOURNAL OF CHEMICAL PHYSICS，2015-08-07
  • 135. DOI Wu, Dengfeng;Dai, Changqing;Li, Shaojie;Cheng, Daojian
    Shape-controlled Synthesis of PdCu Nanocrystals for Formic Acid Oxidation[期刊论文]，CHEMISTRY LETTERS，2015-08-05
  • 136. DOI Niu, Mang;Cui, Rong;Wu, Hao;Cheng, Daojian;Cao, Dapeng
    Enhancement Mechanism of the Conversion Effficiency of Dye-Sensitized Solar Sells Based on Nitrogen-, Fluorine-, and Iodine-Doped TiO2 Photoanodes[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-06-18
  • 137. DOI Yang, Yang;Zhao, Zheng;Cui, Rong;Wu, Hao;Cheng, Daojian
    Structures, Thermal Stability, and Chemical Activity of Crown-Jewel-Structured Pd-Pt Nanoalloys[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-05-21
  • 138. DOI Wang, Jian;Yuan, Wenyan;Cheng, Daojian
    Hybrid genetic-particle swarm algorithm: An efficient method for fast optimization of atomic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2015-05-01
  • 139. DOI Xu, Haoxiang;Cheng, Daojian
    Effect of the Passivating Ligands on the Geometric and Electronic Properties of Au-Pd Nanoalloys[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2015-05-01
  • 140. DOI Chen, Bing;Cheng, Daojian;Zhu, Jiqin
    Synthesis of PtCu nanowires in nonaqueous solvent with enhanced activity and stability for oxygen reduction reaction[期刊论文]，JOURNAL OF POWER SOURCES，2014-12-01
  • 141. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Cao, Dapeng
    Design of the Alkali-Metal-Doped WO3 as a Near-Infrared Shielding Material for Smart Window[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2014-11-19
  • 142. DOI Li, Shaojie;Cheng, Daojian;Qiu, Xiangguo;Cao, Dapeng
    Synthesis of Cu@Pd core-shell nanowires with enhanced activity and stability for formic acid oxidation[期刊论文]，ELECTROCHIMICA ACTA，2014-10-10
  • 143. DOI Chang, Le;Xu, Haoxiang;Cheng, Daojian
    Role of ligand type on the geometric and electronic properties of Ag-Au bimetallic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2014-10-01
  • 144. DOI Zhao, Zheng;Li, Mingjiang;Cheng, Daojian;Zhu, Jiqin
    Understanding the structural properties and thermal stabilities of Au-Pd-Pt trimetallic clustersle[期刊论文]，CHEMICAL PHYSICS，2014-09-30
  • 145. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Fluorite TiO2(111) Surface Phase for Enhanced Visible-Light Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-09-04
  • 146. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    SiH/TiO2 and GeH/TiO2 Heterojunctions: Promising TiO2-based Photocatalysts under Visible Light[期刊论文]，SCIENTIFIC REPORTS，2014-05-02
  • 147. DOI Cheng, Daojian;Xu, Haoxiang;Fortunelli, Alessandro
    Tuning the catalytic activity of Au-Pd nanoalloys in CO oxidation via composition[期刊论文]，JOURNAL OF CATALYSIS，2014-05-01
  • 148. DOI Fang, Yu;Cheng, Daojian;Wu, Wei
    Understanding electronic and optical properties of N-Sn codoped anatase TiO2[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-04-01
  • 149. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding the Mechanism of Photocatalysis Enhancements in the Graphene-like Semiconductor Sheet/TiO2 Composites[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-03-20
  • 150. DOI Cheng, Daojian;Zhang, Minming;Chen, Jianfeng;Yang, Chenxi;Zeng, Xiaofei;Cao, Dapeng
    Computer Screening of Dopants for the Development of New SnO2-Based Transparent Conducting Oxides[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-30
  • 151. DOI Yang, Yang;Cheng, Daojian
    Role of Composition and Geometric Relaxation in CO2 Binding to Cu-Ni Bimetallic Clusters[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-09
  • 152. DOI Zhang, Wei;Cheng, Daojian;Zhu, Jiqin
    Theoretical study of CO catalytic oxidation on free and defective graphene-supported Au-Pd bimetallic clusters[期刊论文]，RSC ADVANCES，2014-01-01
  • 153. DOI Cheng, Daojian;Qiu, Xiangguo;Yu, Haiyan
    Enhancing oxygen reduction reaction activity of Pt-shelled catalysts via subsurface alloying[期刊论文]，PHYSICAL CHEMISTRY CHEMICAL PHYSICS，2014-01-01
  • 154. DOI Tan, Huaqiao;Zhao, Zhao;Niu, Mang;Mao, Chengyu;Cao, Dapeng;Cheng, Daojian;Feng, Pingyun;Sun, Zaicheng
    A facile and versatile method for preparation of colored TiO2 with enhanced solar-driven photocatalytic activity[期刊论文]，NANOSCALE，2014-01-01
  • 155. DOI Li, Mingjiang;Li, Shaojie;Cheng, Daojian
    Influence of adsorbates on the segregation properties of Au-Pd bimetallic clusters[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-01-01
  • 156. DOI Li, Mingjiang;Cheng, Daojian
    Molecular Dynamics Simulation of the Melting Behavior of Crown-Jewel Structured Au-Pd Nanoalloys[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-09-12
  • 157. DOI Cheng, Daojian;Yuan, Shuai;Ferrando, Riccardo
    Structure, chemical ordering and thermal stability of Pt-Ni alloy nanoclusters[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2013-09-04
  • 158. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding Photoelectrochennical Properties of B-N Codoped Anatase TiO2 for Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-08-08
  • 159. DOI Cheng, Daojian;Negreiros, Fabio R.;Apra, Edoardo;Fortunelli, Alessandro
    Computational Approaches to the Chemical Conversion of Carbon Dioxide[期刊论文]，CHEMSUSCHEM，2013-06-01
  • 160. DOI Fang, Yu;Cheng, Daojian;Niu, Mang;Yi, Yongjun;Wu, Wei
    Tailoring the electronic and optical properties of rutile TiO2 by (Nb + Sb, C) codoping from DFT plus U calculations[期刊论文]，CHEMICAL PHYSICS LETTERS，2013-04-19
  • 161. DOI Cheng, Daojian;Cao, Dapeng;Wang, Wenchuan
    Hydrogen storage in porous materials and nanoalloys as catalysts for fuel cell application by using multiscale simulation and experimental methods[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2013-04-07
  • 162. DOI Cheng, Daojian;Jiang, Kun
    Structural stability and kinetics of small carbon clusters on a bimetallic Cu/Ni(111) surface: A first-principles study[期刊论文]，SURFACE SCIENCE，2013-03-01
  • 163. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Enhanced photoelectrochemical performance of anatase TiO2 by metal-assisted S-O coupling for water splitting[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2013-02-06
[+][-] 2025年
  • 1. DOI Zhang, Huimin;Liu, Wenhao;Li, Zhenhao;Qiao, Liang;Chi, Kebin;Guo, Xiaoyan;Cao, Dong;Cheng, Daojian
    Constructing CoP/Ni2P Heterostructure Confined Ru Sub-Nanoclusters for Enhanced Water Splitting in Wide pH Conditions[期刊论文]，Advanced Science，2024-09-18
  • 2. DOI Cao, Dong;Zhang, Zhirong;Cui, Yahui;Zhang, Runhao;Zhang, Lipeng;Zeng, Jie;Cheng, Daojian
    One-Step Approach for Constructing High-Density Single-Atom Catalysts toward Overall Water Splitting at Industrial Current Densities[期刊论文]，Angewandte Chemie-International Edition，2023-02-20
  • 3. DOI Sun, Jindong;Xu, Haoxiang;Ma, Haowen;Zhan, Xuecheng;Zhu, Jiqin;Cheng, Daojian
    Isoprene selective hydrogenation using AgCu-promoted Pd nanoalloys[期刊论文]，FARADAY DISCUSSIONS，2023-01-31
  • 4. DOI Liu, Tianpeng;Liu, Wenhao;Ma, Mengyao;Guo, Linke;Cui, Rong;Cheng, Daojian;Cao, Dong
    Constructing nickel vanadium phosphide nanoarrays with highly active heterointerfaces for water oxidation in alkali media[期刊论文]，ELECTROCHIMICA ACTA，2023-01-20
  • 5. DOI Cao, Dong;Huang, Xiaoyu;Zhang, Huimin;Liu, Wenhao;Cheng, Daojian
    Constructing porous RuCu nanotubes with highly efficient alloy phase for water splitting in different pH conditions[期刊论文]，Chemical Engineering Journal，2023-01-15
  • 6. DOI Wang, Jiayi;Xu, Haoxiang;Che, Chunxia;Zhu, Jiqin;Cheng, Daojian
    Rational Design of PdAg Catalysts for Acetylene Selective Hydrogenation via Structural Descriptor-based Screening Strategy[期刊论文]，ACS Catalysis，2023-01-06
  • 7. DOI Zhang, Huimin;Guo, Xiaoyan;Liu, Wenhao;Wu, Dengfeng;Cao, Dong;Cheng, Daojian
    Regulating surface composition of platinum-copper nanotubes for enhanced hydrogen evolution reaction in all pH values[期刊论文]，Journal of Colloid and Interface Science，2023-01-01
  • 8. DOI Cao, Dong;Shao, Jie;Cui, Yahui;Zhang, Lipeng;Cheng, Daojian
    Interfacial Engineering of Copper–Nickel Selenide Nanodendrites for Enhanced Overall Water Splitting in Alkali Condition[期刊论文]，Small，2023-01-01
  • 9. DOI Wang, Xuning;Xu, Haoxiang;Luo, Yibin;Cheng, Daojian
    High Selective Direct Synthesis of H2O2 over Pd-1@gamma-Al2O3 Single-Atom Catalyst[期刊论文]，CHEMCATCHEM，2022-11-08
  • 10. DOI Deng, Zhuoran;Zhao, Liqiang;Cheng, Daojian
    A high-throughput catalyst synthesis system for Ag-based catalysts[期刊论文]，Review of Scientific Instruments，2022-11-01
  • 11. DOI Xu, Xiaopei;Peng, Zhipeng;Xu, Haoxiang;Cheng, Daojian
    Computational screening of nonmetal dopants to active MoS2 basal-plane for hydrogen evolution reaction via structural descriptor[期刊论文]，Journal of Catalysis，2022-10-31
  • 12. DOI 曹东,许昊翔,Hongliang Li,Chen Feng,Jie Zeng,程道建
    Volcano-type relationship between oxidation states and catalytic activity of single-atom catalysts towards hydrogen evolution[期刊论文]，Nature Communications，2022-10-04
  • 13. DOI Yan, Jingjing;Xu, Haoxiang;Chang, Le;Lin, Aijun;Cheng, Daojian
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single-atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 14. DOI 燕晶晶,许昊翔,常乐,林爱军,程道建
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 15. DOI Cheng, Feipeng;Cheng, Jihao;Nan, Yang;Xie, Yuan;Yang, Tongqian;Cheng, Daojian;Zhu, Jiqin;Xu, Haoxiang
    Enhancing oxidative hydration of ethylene towards ethylene glycol over metal-modified titanosilicate catalysts[期刊论文]，Applied Catalysis A: General，2022-08-05
  • 16. DOI Wen, Qi-Xing;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Design of CuCs-doped Ag-based catalyst for ethylene epoxidation[期刊论文]，Chinese Journal of Chemical Physics，2022-08-01
  • 17. DOI 张眉佳,许昊翔,罗一斌,朱吉钦,程道建
    Enhancing the catalytic performance of PdAu catalysts by W induced strong interaction for the direct synthesis of H2O2[期刊论文]，Catalysis Science & Technology，2022-07-26
  • 18. DOI Deng, Zhuoran;Zhou, Yingcheng;Zhao, Liqiang;Cheng, Daojian
    Structures and structural evolution of M-N (M = Pt, Ag, Au, N=2-20) from combined revised particle swarm optimization and density function theory[期刊论文]，MOLECULAR SIMULATION，2022-07-03
  • 19. DOI Zhang, Huimin;Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Carbon-based material-supported single-atom catalysts for energy conversion[期刊论文]，ISCIENCE，2022-06-17
  • 20. DOI 陈志强;车春霞;吴登峰;温翯;韩伟;张峰;许昊翔;程道建
    乙炔选择性加氢催化剂研究进展[期刊论文]，化工进展，2022-03-17
  • 21. DOI Liu, Ning;Cao, Dong;Liu, Wenhao;Zhang, Huimin;Zhu, Yinhai;Chang, Le;Wu, Dengfeng;Cheng, Daojian
    Constructing La-doped ultrathin Co-based nanostructured electrocatalysts for high-performance water oxidation process[期刊论文]，International Journal of Hydrogen Energy，2022-01-01
  • 22. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Branch-leaf-shaped CuNi@NiFeCu nanodendrites as highly efficient electrocatalysts for overall water splitting[期刊论文]，Applied Catalysis B-Environmental，2021-12-05
  • 23. DOI Zhang, Meijia;Luo, Yibin;Wu, Dengfeng;Li, Qian;Xu, Haoxiang;Cheng, Daojian
    Promoter role of tungsten in W-Pd/Al2O3 catalyst for direct synthesis of H2O2: Modification of Pd/PdO ratio[期刊论文]，APPLIED CATALYSIS A-GENERAL，2021-11-25
  • 24. DOI 孙晋冬;展学成;吴登峰;谢元;马好文;许昊翔;程道建
    碳四炔烃选择性加氢催化剂研究进展[期刊论文]，石油学报(石油加工)，2021-10-15
  • 25. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Construction of Dual-Site Atomically Dispersed Electrocatalysts with Ru-C-5 Single Atoms and Ru-O-4 Nanoclusters for Accelerated Alkali Hydrogen Evolution[期刊论文]，Small，2021-08-01
  • 26. DOI Cao, Dong;Wang, Jiayi;Zhang, Huimin;Xu, Haoxiang;Cheng, Daojian
    Growth of IrCu nanoislands with rich IrCu/Ir interfaces enables highly efficient overall water splitting in non-acidic electrolytes[期刊论文]，Chemical Engineering Journal，2021-07-15
  • 27. DOI Zhu, Yinhai;Cao, Dong;Liu, Ning;Cheng, Daojian
    One-step synthesis of atomic Ru doped ultra-thin Co(OH)(2) nanosheets for oxygen evolution reaction in different pH values[期刊论文]，International Journal of Hydrogen Energy，2021-06-28
  • 28. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Metal Dopants in Enhancing the Selectivity of Ag-Catalyzed Ethylene Epoxidation: Optimizing Oxophilicity of Reaction Site via Cocatalytic Mechanism[期刊论文]，ACS Catalysis，2021-03-19
  • 29. DOI 吴建国;吴登峰;程道建
    丙烷脱氢制丙烯用单原子催化剂研究进展[期刊论文]，化工进展，2021-03-16
  • 30. DOI Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Review on Synthesis and Catalytic Coupling Mechanism of Highly Active Electrocatalysts for Water Splitting[期刊论文]，Energy Technology，2021-02-01
  • 31. DOI Ma, Haowen;Xu, Xiaopei;Xu, Haoxiang;Feng, Huixia;Xie, Yuan;Cheng, Daojian
    Understanding composition-dependent catalytic performance of PdAg for the hydrogenation of 1,3-butadiene to 1-butene[期刊论文]，CATALYSIS COMMUNICATIONS，2021-01-15
  • 32. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文]，Advances in Physics-X，2021-01-01
  • 33. DOI Huang, Xingkai;Xu, Haoxiang;Cao, Dong;Cheng, Daojian
    Interface construction of P-Substituted MoS2 as efficient and robust electrocatalyst for alkaline hydrogen evolution reaction[期刊论文]，Nano Energy，2020-12-01
  • 34. DOI Yang, Liu,许昊翔,Liu, Huibing,曾晓飞,程道建,黄燕,Zheng, Lirong,Cao, Rui,曹达鹏
    Oxygen-Reconstituted Active Species of Single-Atom Cu Catalysts for Oxygen Reduction Reaction[期刊论文]，Research，2020-10-05
  • 35. DOI Xu, Xiaopei,许昊翔,程道建
    Identification of the Anti-triangular Etched MoS2 with Comparative Activity with Commercial Pt for Hydrogen Evolution Reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-10-04
  • 36. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Growth of Highly Active Amorphous RuCu Nanosheets on Cu Nanotubes for the Hydrogen Evolution Reaction in Wide pH Values[期刊论文]，Small，2020-09-01
  • 37. DOI 许昊翔,程道建
    First-principles-aided Thermodynamic Modeling of Transition-metal Heterogeneous Catalysts: A review.[期刊论文]，Green Energy & Environment，2020-07-14
  • 38. DOI Xu, Haoxiang;Cheng, Daojian
    First-principles-aided thermodynamic modeling of transition-metal heterogeneous catalysts: A review[期刊论文]，GREEN ENERGY & ENVIRONMENT，2020-07-01
  • 39. DOI Che, Chunxia;Xu, Haoxiang;Wen, He;Gou, Galian;Cheng, Daojian
    Theoretical Study on the Structural, Thermal and Phase Stability of Pt-Cu Alloy Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2020-05-01
  • 40. DOI Zhang, Wei;Zhu, Jiqin;Cheng, Daojian;Zeng, Xiao Cheng
    PtCoNi Alloy Nanoclusters for Synergistic Catalytic Oxygen Reduction Reaction[期刊论文]，ACS APPLIED NANO MATERIALS，2020-03-01
  • 41. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Construction of Defect-Rich RhCu Nanotubes with Highly Active Rh3Cu1 Alloy Phase for Overall Water Splitting in All pH Values[期刊论文]，ADVANCED ENERGY MATERIALS，2020-03-01
  • 42. DOI Wu, Dengfeng;Zhang, Wei;Lin, Aijun;Cheng, Daojian
    Low Pt-Content Ternary PtNiCu Nanoparticles with Hollow Interiors and Accessible Surfaces as Enhanced Multifunctional Electrocatalysts[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2020-02-26
  • 43. DOI Wu, Dengfeng;Yang, Yang;Dai, Changqing;Cheng, Daojian
    Enhanced oxygen reduction activity of PtCu nanoparticles by morphology tuning and transition-metal doping[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-02-07
  • 44. DOI Huang, Xingkai;Xu, Xiaopei;Luan, Xiaoxu;Cheng, Daojian
    CoP nanowires coupled with CoMoP nanosheets as a highly efficient cooperative catalyst for hydrogen evolution reaction[期刊论文]，NANO ENERGY，2020-02-01
  • 45. DOI Zhou, Yingcheng;Zhao, Zheng;Cheng, Daojian
    Cluster structure prediction via revised particle-swarm optimization algorithm[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2020-02-01
  • 46. DOI Li, Lin-Xin;Xie, Zhi-Hui;Fernandez, Carlos;Wu, Liang;Cheng, Daojian;Jiang, Xiao-Hui;Zhong, Chuan-Jian
    Development of a thiophene derivative modified LDH coating for Mg alloy corrosion protection[期刊论文]，ELECTROCHIMICA ACTA，2020-01-10
  • 47. DOI Zhang, Junmeng;Xu, Xiaopei;Yang, Liu;Cheng, Daojian;Cao, Dapeng
    Single-Atom Ru Doping Induced Phase Transition of MoS2 and S Vacancy for Hydrogen Evolution Reaction[期刊论文]，SMALL METHODS，2019-12-11
  • 48. DOI Zhao, Zheng,许昊翔,Feng, Zongyu,Zhang, Yongqi,Cui, Meisheng,曹达鹏,程道建
    Design of High-Performance Co-Based Alloy Nanocatalysts for the Oxygen Reduction Reaction[期刊论文]，Chemistry - A European Journal，2019-12-03
  • 49. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Chlorine in Selectivity Enhancement of Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-11-27
  • 50. DOI Xu, Xiaopei;Xu, Haoxiang;Cheng, Daojian
    Design of high-performance MoS2 edge supported single-metal atom bifunctional catalysts for overall water splitting via a simple equation[期刊论文]，NANOSCALE，2019-11-14
  • 51. DOI Wu, Dengfeng;Cheng, Daojian
    Structure-controlled synthesis of one-dimensional PdCu nanoscatalysts via a seed-mediated approach for oxygen reduction reaction[期刊论文]，APPLIED SURFACE SCIENCE，2019-11-01
  • 52. DOI Huang, Xiaoyu;Yang, Yang;Cheng, Daojian
    Hydrogen generation from formic acid decomposition on Pd-Cu nanoalloys[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-09-13
  • 53. DOI Zhang, Wei;Deibert, David L.;Cheng, Daojian;Zeng, Xiao Cheng
    Magnetism in bimetallic PtxNiN-x clusters via cross-atomic coupling[期刊论文]，JOURNAL OF MATERIALS CHEMISTRY C，2019-08-14
  • 54. DOI Ma, Haowen;Yang, Yang;Feng, Huixia;Cheng, Daojian
    DFT Study of Pyrolysis Gasoline Hydrogenation on Pd(100), Pd(110) and Pd(111) Surfaces[期刊论文]，CATALYSIS LETTERS，2019-08-01
  • 55. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Fortunelli, Alessandro;Cheng, Daojian
    Selectivity-Driven Design of the Ag-Cu Alloys for the Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-07-24
  • 56. DOI Cao, Dong;Cheng, Daojian
    One-pot synthesis of copper-nickel sulfide nanowires for overall water splitting in alkaline media[期刊论文]，CHEMICAL COMMUNICATIONS，2019-07-18
  • 57. DOI Huang, Xingkai;Xu, Xiaopei;Li, Chao;Wu, Dengfeng;Cheng, Daojian;Cao, Dapeng
    Vertical CoP Nanoarray Wrapped by N,P-Doped Carbon for Hydrogen Evolution Reaction in Both Acidic and Alkaline Conditions[期刊论文]，ADVANCED ENERGY MATERIALS，2019-06-01
  • 58. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Cheng, Daojian
    The synergistic effect between crystal planes and promoters on Ag-catalyzed ethylene epoxidation[期刊论文]，APPLIED SURFACE SCIENCE，2019-05-15
  • 59. DOI Yang, Liu;Xu, Haoxiang;Liu, Huibing;Cheng, Daojian;Cao, Dapeng
    Active Site Identification and Evaluation Criteria of In Situ Grown CoTe and NiTe Nanoarrays for Hydrogen Evolution and Oxygen Evolution Reactions[期刊论文]，SMALL METHODS，2019-05-10
  • 60. DOI Yang, Chenxi;Wang, Guoqing;Liang, Aimin;Yue, Yi;Peng, Hui;Cheng, Daojian
    Understanding the role of Au in the selective hydrogenation of acetylene on trimetallic PdAgAu catalytic surface[期刊论文]，CATALYSIS COMMUNICATIONS，2019-05-05
  • 61. DOI Li, Pengcheng;Wu, Dengfeng;Dai, Changqing;Huang, Xingkai;Li, Chao;Yin, Zhen;Zhou, Song;Lv, Zhengang;Cheng, Daojian;Zhu, Jiqin;Xu, Jian;Liu, Xi
    Controlled Synthesis of Copper-Doped Molybdenum Carbide Catalyst with Enhanced Activity and Stability for Hydrogen Evolution Reaction[期刊论文]，CATALYSIS LETTERS，2019-05-01
  • 62. DOI Elouarzaki Kamal,Wang Yian,Kannan Vishvak,许昊翔,程道建,Lee Jong-Min,Fisher Adrian C.
    Hydrogenase-Like Electrocatalytic Activation and Inactivation Mechanism by Three-Dimensional Binderless Molecular Catalyst[期刊论文]，ACS Applied Energy Materials，2019-04-09
  • 63. DOI Xu, Haoxiang;Cheng, Daojian
    Rational design of transition metal nanocatalyst by structure descriptor[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2019-03-31
  • 64. DOI Yang, Mengjie;Wu, Dengfeng;Cheng, Daojian
    Biomass-derived porous carbon supported Co-CoO yolk-shell nanoparticles as enhanced multifunctional electrocatalysts[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-03-08
  • 65. DOI Zhao, Zheng;Kong, Kewei;Wang, Shixian;Zhou, Yingcheng;Cheng, Daojian;Wang, Wenchuan;Zeng, Xiao Cheng;Li, Hui
    Understanding Hygroscopic Nucleation of Sulfate Aerosols: Combination of Molecular Dynamics Simulation with Classical Nucleation Theory[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY LETTERS，2019-03-07
  • 66. DOI Lv, Yanlong,朱琳,许昊翔,Yang, Liu,刘志平,程道建,Cao, Xiaohua,Yun Jimmy,曹达鹏
    Core/shell Template-derived Co, N-doped Carbon Bifunctional Electrocatalysts for Rechargeable Zn-air Battery[期刊论文]，Engineered Science，2019-02-28
  • 67. DOI Zhao, Zheng;Xu, Haoxiang;Gao, Yi;Cheng, Daojian
    Universal description of heating-induced reshaping preference of core-shell bimetallic nanoparticles[期刊论文]，NANOSCALE，2019-01-21
  • 68. DOI Yang, Yang,Zhao, Zheng,程道建,朱吉钦
    Effect of Size and Composition on the Structural Stability of Pt–Ni Nanoalloys[期刊论文]，Journal of Cluster Science，2019-01-14
  • 69. DOI Nan, Yang;Wang, Yinuo;Cao, Dong;Yang, Yang;Cheng, Daojian
    Adsorption and dissociation of borohydride on different Ir-Ni alloy surfaces[期刊论文]，Appl Surf Sci，2019-01-01
  • 70. DOI Yang, Yang,许昊翔,曹达鹏,曾晓成,程道建
    Hydrogen Production via Efficient Formic Acid Decomposition: Engineering the Surface Structure of Pd-Based Alloy Catalysts by Design[期刊论文]，ACS Catalysis，2018-12-07
  • 71. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Zhu, Jiqin;Cheng, Daojian
    Facet-dependent diffusion of atomic oxygen on Ag surfaces[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2018-12-01
  • 72. DOI Chang, Le;Cheng, Daojian;Sementa, Luca;Fortunelli, Alessandro
    Hydrogen evolution reaction (HER) on Au@Ag ultrananoclusters as electro-catalysts[期刊论文]，NANOSCALE，2018-10-07
  • 73. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi;Zeng, Xiao Cheng
    Assessment of Catalytic Activities of Gold Nanoclusters with Simple Structure Descriptors[期刊论文]，ACS CATALYSIS，2018-10-01
  • 74. DOI Yang, Yang;Dai, Changqing;Wu, Dengfeng;Liu, Zhiping;Cheng, Daojian
    The Size Effect of PdCu Bimetallic Nanoparticles on Oxygen Reduction Reaction Activity[期刊论文]，CHEMELECTROCHEM，2018-09-12
  • 75. DOI Lian, Xiaojun;Niu, Mang;Huang, Yan;Cheng, Daojian
    MoS2-CdS heterojunction with enhanced photocatalytic activity: A first principles study[期刊论文]，JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS，2018-09-01
  • 76. DOI Huang, Yichao;Hu, Jun;Xu, Haoxiang;Bian, Wei;Ge, Jingxuan;Zang, Dejin;Cheng, Daojian;Lv, Yaokang;Zhang, Cheng;Gu, Jing;Wei, Yongge
    Fine Tuning Electronic Structure of Catalysts through Atomic Engineering for Enhanced Hydrogen Evolution[期刊论文]，ADVANCED ENERGY MATERIALS，2018-08-27
  • 77. DOI Miao, Xue-Pei;Cheng, Dao-Jian;Dai, Ya-Dong;Meng, Yan;Li, Xiao-Yu
    Origin of Modulus Improvement for Epoxide-terminated Hyperbranched Poly(ether sulphone)/DGEBA/TETA Systems[期刊论文]，CHINESE JOURNAL OF POLYMER SCIENCE，2018-08-01
  • 78. DOI Chang, Le;Baseggio, Oscar;Sernenta, Luca;Cheng, Daojian;Fronzoni, Giovanna;Toffoli, Daniele;Apra, Edoardo;Stener, Mauro;Fortunelli, Alessandro
    Individual Component Map of Rotatory Strength and Rotatory Strength Density Plots As Analysis Tools of Circular Dichroism Spectra of Complex Systems[期刊论文]，JOURNAL OF CHEMICAL THEORY AND COMPUTATION，2018-07-01
  • 79. DOI Elouarzaki, Kamal;Cheng, Daojian;Fisher, Adrian C.;Lee, Jong-Min
    Coupling orientation and mediation strategies for efficient electron transfer in hybrid biofuel cells[期刊论文]，NATURE ENERGY，2018-07-01
  • 80. DOI Wang, Zegao;Li, Qiang;Xu, Haoxiang;Dahl-Petersen, Christian;Yang, Qian;Cheng, Daojian;Cao, Dapeng;Besenbacher, Flemming;Lauritsen, Jeppe V.;Helveg, Stig;Dong, Mingdong
    Controllable etching of MoS2 basal planes for enhanced hydrogen evolution through the formation of active edge sites[期刊论文]，NANO ENERGY，2018-07-01
  • 81. DOI Yang, Liu;Cheng, Daojian;Zeng, Xiaofei;Wan, Xin;Shui, Jianglan;Xiang, Zhonghua;Cao, Dapeng
    Unveiling the high-activity origin of single-atom iron catalysts for oxygen reduction reaction[期刊论文]，PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA，2018-06-26
  • 82. DOI 杨洋,Yu, Haiyan,Cai, Yushun,Ferrando, Riccardo,程道建
    Origin of enhanced stability and oxygen adsorption capacity of mediumsized Pt–Ni nanoclusters[期刊论文]，Journal of Physics: Condensed Matter，2018-06-22
  • 83. DOI Yu, Haiyan,Yang, Liu,程道建,曹达鹏
    Zeolitic-imidazolate Framework (ZIF)@ZnCo-ZIF Core-shell Template Derived Co, N-doped Carbon Catalysts for Oxygen Reduction Reaction[期刊论文]，Engineered Science，2018-06-02
  • 84. DOI 吴登峰,Zhang, Xin,朱吉钦,程道建
    Concerted Catalysis on Tanghulu-like Cu@Zeolitic Imidazolate Framework-8 (ZIF-8) Nanowires with Tuning Catalytic Performances for 4-nitrophenol Reduction[期刊论文]，Engineered Science，2018-05-21
  • 85. DOI Huang, Yan;Wu, Dengfeng;Cao, Dapeng;Cheng, Daojian
    Facile preparation of biomass-derived bifunctional electrocatalysts for oxygen reduction and evolution reactions[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2018-05-03
  • 86. DOI Xu, Haoxiang;Cheng, Daojian;Cao, Dapeng;Zeng, Xiao Cheng
    A universal principle for a rational design of single-atom electrocatalysts[期刊论文]，NATURE CATALYSIS，2018-05-01
  • 87. DOI Li, Zhenhao;Zhu, Lin;Chen, Jian-Feng;Cheng, Daojian
    Enhanced Ethylene Oxide Selectivity by Cu and Re Dual-Promoted Ag Catalysts[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2018-03-28
  • 88. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian
    Enhanced photochemical performance of hexagonal WO3 by metal-assisted S-O coupling for solar-driven water splitting[期刊论文]，SCIENCE CHINA-MATERIALS，2018-01-01
  • 89. DOI Xu, Haoxiang;Xu, Cong-Qiao;Cheng, Daojian;Li, Jun
    Identification of activity trends for CO oxidation on supported transition-metal single-atom catalysts[期刊论文]，CATALYSIS SCIENCE & TECHNOLOGY，2017-12-21
  • 90. DOI Ren, Dongmei;Cheng, Gang;Li, Jianwei;Li, Jinbing;Dai, Wujun;Sun, XinXin;Cheng, Daojian
    Effect of Rhenium Loading Sequence on Selectivity of Ag-Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-12-01
  • 91. DOI Huang, Xingkai;Wu, Dengfeng;Cheng, Daojian
    Porous Co2P nanowires as high efficient bifunctional catalysts for 4-nitrophenol reduction and sodium borohydride hydrolysis[期刊论文]，JOURNAL OF COLLOID AND INTERFACE SCIENCE，2017-12-01
  • 92. DOI Ren, Dongmei;Xu, Haoxiang;Li, Jianwei;Li, Jinhing;Cheng, Daojian
    Origin of enhanced ethylene oxide selectivity by Cs-promoted silver catalyst[期刊论文]，MOLECULAR CATALYSIS，2017-11-01
  • 93. DOI Wei, Yongsheng;Huang, Xingkai;Wang, Junyan;Yu, Haiyan;Zhao, Xinsheng;Cheng, Daojian
    Synthesis of bifunctional non-noble monolithic catalyst Co-W-P/carbon cloth for sodium borohydride hydrolysis and reduction of 4-nitrophenol[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2017-10-12
  • 94. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 95. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 96. DOI Yan, Bailu;Zhao, Zheng;Zhou, Yingcheng;Yuan, Wenyan;Li, Jian;Wu, Jun;Cheng, Daojian
    A particle swarm optimization algorithm with random learning mechanism and Levy flight for optimization of atomic clusters[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2017-10-01
  • 97. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 98. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 99. DOI Yang, Yang;Dai, Changqing;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    A full understanding of oxygen reduction reaction mechanism on Au(111) surface[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2017-09-13
  • 100. DOI Shan, Aixian;Chen, Chinping;Zhang, Wei;Cheng, Daojian;Shen, Xi;Yu, Richeng;Wang, Rongming
    Giant enhancement and anomalous temperature dependence of magnetism in monodispersed NiPt2 nanoparticles[期刊论文]，NANO RESEARCH，2017-09-01
  • 101. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 102. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 103. DOI Zhang, Xing;Wu, Dengfeng;Cheng, Daojian
    Component-dependent electrocatalytic activity of PdCu bimetallic nanoparticles for hydrogen evolution reaction[期刊论文]，ELECTROCHIMICA ACTA，2017-08-20
  • 104. DOI Zhao, Zheng;Wang, Fang-Hui;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Phase stability and segregation behavior of nickel-based nanoalloys based on theory and simulation[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2017-06-25
  • 105. DOI Wu, Dengfeng;Zhang, Wei;Cheng, Daojian
    Facile Synthesis of Cu/NiCu Electrocatalysts Integrating Alloy, Core Shell, and One-Dimensional Structures for Efficient Methanol Oxidation Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2017-06-14
  • 106. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 107. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 108. DOI Zhang, Wei;Shan, Shiyao;Luo, Jin;Fisher, Adrian;Chen, Jian-Feng;Zhong, Chuan-Jian;Zhu, Jiqin;Chen, Daojian
    Origin of Enhanced Activities for CO Oxidation and O-2 Reaction over Composition-Optimized Pd50Cu50 Nanoalloy Catalysts[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2017-05-25
  • 109. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin;Cheng, Daojian
    Mechanistic insight into the facet-dependent selectivity of ethylene epoxidation on Ag nanocatalysts[期刊论文]，APPLIED CATALYSIS A: GENERAL，2017-05-25
  • 110. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin
    Ni (111)-supported graphene as a potential catalyst for high-efficient CO oxidation[期刊论文]，CARBON，2017-05-01
  • 111. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi
    Design of High-Performance Pd-Based Alloy Nanocatalysts for Direct Synthesis of H2O2[期刊论文]，ACS CATALYSIS，2017-03-01
  • 112. DOI Yu, Haiyan;Cao, Dapeng;Fisher, Adrian;Johnston, Roy L.;Cheng, Daojian
    Size effect on the adsorption and dissociation of CO2 on Co nanoclusters[期刊论文]，APPLIED SURFACE SCIENCE，2017-02-28
  • 113. DOI Lian, Xiaojun;Zhao, Zheng;Cheng, Daojian
    Recent progress on triphenylamine materials: synthesis, properties, and applications[期刊论文]，MOLECULAR CRYSTALS AND LIQUID CRYSTALS，2017-01-01
  • 114. DOI Wu, Dengfeng;Xu, Haoxiang;Cao, Dapeng;Fisher, Adrian;Gao, Yi;Cheng, Daojian
    PdCu alloy nanoparticle-decorated copper nanotubes as enhanced electrocatalysts: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-12-09
  • 115. DOI Dai, Changqing;Yang, Yang;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Interaction of CO2 with metal cluster-functionalized ionic liquids[期刊论文]，JOURNAL OF CO2 UTILIZATION，2016-12-01
  • 116. DOI Wei, Chengcheng;Zhao, Zheng;Fisher, Adrian;Zhu, Jiqin;Cheng, Daojian
    Theoretical Study on the Structures and Thermal Properties of Ag-Pt-Ni Trimetallic Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-11-01
  • 117. DOI Cheng, Daojian;Wu, Dengfeng;Xu, Haoxiang;Fisher, Adrian
    Composition-controlled Synthesis of PtCuNPs Shells on Copper Nanowires as Electrocatalysts[期刊论文]，CHEMISTRYSELECT，2016-09-16
  • 118. DOI Yu, Haiyan;Fisher, Adrian;Cheng, Daojian;Cao, Dapeng
    Cu,N-codoped Hierarchical Porous Carbons as Electrocatalysts for Oxygen Reduction Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2016-08-24
  • 119. DOI Yang, Yang;Dai, Changqing;Shen, Yanchun;Fisher, Adrian;Cheng, Daojian
    Design of binary and ternary platinum shelled electrocatalysts with inexpensive metals for the oxygen reduction reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2016-08-10
  • 120. DOI Liu, Xinyue;Dai, Changqing;Wu, Dengfeng;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Facile Synthesis of PdAgCo Trimetallic Nanoparticles for Formic Acid Electrochemical Oxidation[期刊论文]，CHEMISTRY LETTERS，2016-07-05
  • 121. DOI 程道建
    双金属纳米电催化:理论和实验研究[会议论文]，中国化学会第30届学术年会摘要集-第二十九分会：电化学材料，2016-07-01
  • 122. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    A density functional theory study of sulfur adsorption on Ag-Au nanoalloys[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2016-06-01
  • 123. DOI 程道建
    双金属纳米催化:理论和实验研究[会议论文]，第七届全国物理无机化学学术会议论文集，2016-05-06
  • 124. DOI Zhao, Zheng;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Magnetic Properties of Pt-Based Nanoalloys: A Critical Review[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-05-01
  • 125. DOI Zhao, Zheng;Fisher, Adrian;Cheng, Daojian
    Phase diagram and segregation of Ag-Co nanoalloys: insights from theory and simulation[期刊论文]，NANOTECHNOLOGY，2016-03-18
  • 126. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Huan, Haifeng;Cao, Dapeng
    Enhanced near-infrared shielding ability of (Li, K)-codoped WO3 for smart windows: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-02-09
  • 127. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Highly sensitive and selective colorimetric detection of sulphide using Ag-Au nanoalloys: a DFT study[期刊论文]，RSC ADVANCES，2016-01-01
  • 128. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文]，MOLECULAR SIMULATION，2016-01-01
  • 129. DOI Chang, Le;Liu, Zhiping;Cheng, Daojian
    Optical properties of Ag-Au nanoclusters for sulphide sensing from TDDFT calculations[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2015-12-25
  • 130. DOI Zhang, Wei;Cui, Rong;Wu, Hao;Zhu, Jiqin;Cheng, Daojian
    CO oxidation mechanism on a MgO(100) supported PtxAu3-x clusters[期刊论文]，APPLIED SURFACE SCIENCE，2015-11-30
  • 131. DOI Zhang, Wei;Sumer, Aslihan;Jellinek, Julius;Cheng, Daojian
    Morphology Tailoring of Pt Nanocatalysts for the Oxygen Reduction Reaction: The Paradigm of Pt-13[期刊论文]，CHEMNANOMAT，2015-11-01
  • 132. DOI Wu, Dengfeng;Cheng, Daojian
    Core/shell AgNi/PtAgNi nanoparticles as methanol-tolerant oxygen reduction electrocatalysts[期刊论文]，ELECTROCHIMICA ACTA，2015-10-20
  • 133. DOI wang,qian,fang,yu,孟洪,毋伟,初广文,邹海魁,程道建,陈建峰
    Enhanced simulated sunlight induced photocatalytic activity by pomegranate-like S doped SnO2@TiO2 spheres[期刊论文]，Colloids and Surfaces A: Physicochemical and Engineering Aspects，2015-10-05
  • 134. DOI Niu, Mang;Tan, Huaqiao;Cheng, Daojian;Sun, Zaicheng;Cao, Dapeng
    Bandgap engineering of Magnei phase TinO2n-1: Electron-hole self-compensation[期刊论文]，JOURNAL OF CHEMICAL PHYSICS，2015-08-07
  • 135. DOI Wu, Dengfeng;Dai, Changqing;Li, Shaojie;Cheng, Daojian
    Shape-controlled Synthesis of PdCu Nanocrystals for Formic Acid Oxidation[期刊论文]，CHEMISTRY LETTERS，2015-08-05
  • 136. DOI Niu, Mang;Cui, Rong;Wu, Hao;Cheng, Daojian;Cao, Dapeng
    Enhancement Mechanism of the Conversion Effficiency of Dye-Sensitized Solar Sells Based on Nitrogen-, Fluorine-, and Iodine-Doped TiO2 Photoanodes[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-06-18
  • 137. DOI Yang, Yang;Zhao, Zheng;Cui, Rong;Wu, Hao;Cheng, Daojian
    Structures, Thermal Stability, and Chemical Activity of Crown-Jewel-Structured Pd-Pt Nanoalloys[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-05-21
  • 138. DOI Wang, Jian;Yuan, Wenyan;Cheng, Daojian
    Hybrid genetic-particle swarm algorithm: An efficient method for fast optimization of atomic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2015-05-01
  • 139. DOI Xu, Haoxiang;Cheng, Daojian
    Effect of the Passivating Ligands on the Geometric and Electronic Properties of Au-Pd Nanoalloys[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2015-05-01
  • 140. DOI Chen, Bing;Cheng, Daojian;Zhu, Jiqin
    Synthesis of PtCu nanowires in nonaqueous solvent with enhanced activity and stability for oxygen reduction reaction[期刊论文]，JOURNAL OF POWER SOURCES，2014-12-01
  • 141. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Cao, Dapeng
    Design of the Alkali-Metal-Doped WO3 as a Near-Infrared Shielding Material for Smart Window[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2014-11-19
  • 142. DOI Li, Shaojie;Cheng, Daojian;Qiu, Xiangguo;Cao, Dapeng
    Synthesis of Cu@Pd core-shell nanowires with enhanced activity and stability for formic acid oxidation[期刊论文]，ELECTROCHIMICA ACTA，2014-10-10
  • 143. DOI Chang, Le;Xu, Haoxiang;Cheng, Daojian
    Role of ligand type on the geometric and electronic properties of Ag-Au bimetallic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2014-10-01
  • 144. DOI Zhao, Zheng;Li, Mingjiang;Cheng, Daojian;Zhu, Jiqin
    Understanding the structural properties and thermal stabilities of Au-Pd-Pt trimetallic clustersle[期刊论文]，CHEMICAL PHYSICS，2014-09-30
  • 145. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Fluorite TiO2(111) Surface Phase for Enhanced Visible-Light Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-09-04
  • 146. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    SiH/TiO2 and GeH/TiO2 Heterojunctions: Promising TiO2-based Photocatalysts under Visible Light[期刊论文]，SCIENTIFIC REPORTS，2014-05-02
  • 147. DOI Cheng, Daojian;Xu, Haoxiang;Fortunelli, Alessandro
    Tuning the catalytic activity of Au-Pd nanoalloys in CO oxidation via composition[期刊论文]，JOURNAL OF CATALYSIS，2014-05-01
  • 148. DOI Fang, Yu;Cheng, Daojian;Wu, Wei
    Understanding electronic and optical properties of N-Sn codoped anatase TiO2[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-04-01
  • 149. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding the Mechanism of Photocatalysis Enhancements in the Graphene-like Semiconductor Sheet/TiO2 Composites[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-03-20
  • 150. DOI Cheng, Daojian;Zhang, Minming;Chen, Jianfeng;Yang, Chenxi;Zeng, Xiaofei;Cao, Dapeng
    Computer Screening of Dopants for the Development of New SnO2-Based Transparent Conducting Oxides[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-30
  • 151. DOI Yang, Yang;Cheng, Daojian
    Role of Composition and Geometric Relaxation in CO2 Binding to Cu-Ni Bimetallic Clusters[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-09
  • 152. DOI Zhang, Wei;Cheng, Daojian;Zhu, Jiqin
    Theoretical study of CO catalytic oxidation on free and defective graphene-supported Au-Pd bimetallic clusters[期刊论文]，RSC ADVANCES，2014-01-01
  • 153. DOI Cheng, Daojian;Qiu, Xiangguo;Yu, Haiyan
    Enhancing oxygen reduction reaction activity of Pt-shelled catalysts via subsurface alloying[期刊论文]，PHYSICAL CHEMISTRY CHEMICAL PHYSICS，2014-01-01
  • 154. DOI Tan, Huaqiao;Zhao, Zhao;Niu, Mang;Mao, Chengyu;Cao, Dapeng;Cheng, Daojian;Feng, Pingyun;Sun, Zaicheng
    A facile and versatile method for preparation of colored TiO2 with enhanced solar-driven photocatalytic activity[期刊论文]，NANOSCALE，2014-01-01
  • 155. DOI Li, Mingjiang;Li, Shaojie;Cheng, Daojian
    Influence of adsorbates on the segregation properties of Au-Pd bimetallic clusters[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-01-01
  • 156. DOI Li, Mingjiang;Cheng, Daojian
    Molecular Dynamics Simulation of the Melting Behavior of Crown-Jewel Structured Au-Pd Nanoalloys[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-09-12
  • 157. DOI Cheng, Daojian;Yuan, Shuai;Ferrando, Riccardo
    Structure, chemical ordering and thermal stability of Pt-Ni alloy nanoclusters[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2013-09-04
  • 158. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding Photoelectrochennical Properties of B-N Codoped Anatase TiO2 for Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-08-08
  • 159. DOI Cheng, Daojian;Negreiros, Fabio R.;Apra, Edoardo;Fortunelli, Alessandro
    Computational Approaches to the Chemical Conversion of Carbon Dioxide[期刊论文]，CHEMSUSCHEM，2013-06-01
  • 160. DOI Fang, Yu;Cheng, Daojian;Niu, Mang;Yi, Yongjun;Wu, Wei
    Tailoring the electronic and optical properties of rutile TiO2 by (Nb + Sb, C) codoping from DFT plus U calculations[期刊论文]，CHEMICAL PHYSICS LETTERS，2013-04-19
  • 161. DOI Cheng, Daojian;Cao, Dapeng;Wang, Wenchuan
    Hydrogen storage in porous materials and nanoalloys as catalysts for fuel cell application by using multiscale simulation and experimental methods[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2013-04-07
  • 162. DOI Cheng, Daojian;Jiang, Kun
    Structural stability and kinetics of small carbon clusters on a bimetallic Cu/Ni(111) surface: A first-principles study[期刊论文]，SURFACE SCIENCE，2013-03-01
  • 163. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Enhanced photoelectrochemical performance of anatase TiO2 by metal-assisted S-O coupling for water splitting[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2013-02-06
[+][-] 2024年
  • 1. DOI Zhang, Huimin;Liu, Wenhao;Li, Zhenhao;Qiao, Liang;Chi, Kebin;Guo, Xiaoyan;Cao, Dong;Cheng, Daojian
    Constructing CoP/Ni2P Heterostructure Confined Ru Sub-Nanoclusters for Enhanced Water Splitting in Wide pH Conditions[期刊论文]，Advanced Science，2024-09-18
  • 2. DOI Cao, Dong;Zhang, Zhirong;Cui, Yahui;Zhang, Runhao;Zhang, Lipeng;Zeng, Jie;Cheng, Daojian
    One-Step Approach for Constructing High-Density Single-Atom Catalysts toward Overall Water Splitting at Industrial Current Densities[期刊论文]，Angewandte Chemie-International Edition，2023-02-20
  • 3. DOI Sun, Jindong;Xu, Haoxiang;Ma, Haowen;Zhan, Xuecheng;Zhu, Jiqin;Cheng, Daojian
    Isoprene selective hydrogenation using AgCu-promoted Pd nanoalloys[期刊论文]，FARADAY DISCUSSIONS，2023-01-31
  • 4. DOI Liu, Tianpeng;Liu, Wenhao;Ma, Mengyao;Guo, Linke;Cui, Rong;Cheng, Daojian;Cao, Dong
    Constructing nickel vanadium phosphide nanoarrays with highly active heterointerfaces for water oxidation in alkali media[期刊论文]，ELECTROCHIMICA ACTA，2023-01-20
  • 5. DOI Cao, Dong;Huang, Xiaoyu;Zhang, Huimin;Liu, Wenhao;Cheng, Daojian
    Constructing porous RuCu nanotubes with highly efficient alloy phase for water splitting in different pH conditions[期刊论文]，Chemical Engineering Journal，2023-01-15
  • 6. DOI Wang, Jiayi;Xu, Haoxiang;Che, Chunxia;Zhu, Jiqin;Cheng, Daojian
    Rational Design of PdAg Catalysts for Acetylene Selective Hydrogenation via Structural Descriptor-based Screening Strategy[期刊论文]，ACS Catalysis，2023-01-06
  • 7. DOI Zhang, Huimin;Guo, Xiaoyan;Liu, Wenhao;Wu, Dengfeng;Cao, Dong;Cheng, Daojian
    Regulating surface composition of platinum-copper nanotubes for enhanced hydrogen evolution reaction in all pH values[期刊论文]，Journal of Colloid and Interface Science，2023-01-01
  • 8. DOI Cao, Dong;Shao, Jie;Cui, Yahui;Zhang, Lipeng;Cheng, Daojian
    Interfacial Engineering of Copper–Nickel Selenide Nanodendrites for Enhanced Overall Water Splitting in Alkali Condition[期刊论文]，Small，2023-01-01
  • 9. DOI Wang, Xuning;Xu, Haoxiang;Luo, Yibin;Cheng, Daojian
    High Selective Direct Synthesis of H2O2 over Pd-1@gamma-Al2O3 Single-Atom Catalyst[期刊论文]，CHEMCATCHEM，2022-11-08
  • 10. DOI Deng, Zhuoran;Zhao, Liqiang;Cheng, Daojian
    A high-throughput catalyst synthesis system for Ag-based catalysts[期刊论文]，Review of Scientific Instruments，2022-11-01
  • 11. DOI Xu, Xiaopei;Peng, Zhipeng;Xu, Haoxiang;Cheng, Daojian
    Computational screening of nonmetal dopants to active MoS2 basal-plane for hydrogen evolution reaction via structural descriptor[期刊论文]，Journal of Catalysis，2022-10-31
  • 12. DOI 曹东,许昊翔,Hongliang Li,Chen Feng,Jie Zeng,程道建
    Volcano-type relationship between oxidation states and catalytic activity of single-atom catalysts towards hydrogen evolution[期刊论文]，Nature Communications，2022-10-04
  • 13. DOI Yan, Jingjing;Xu, Haoxiang;Chang, Le;Lin, Aijun;Cheng, Daojian
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single-atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 14. DOI 燕晶晶,许昊翔,常乐,林爱军,程道建
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 15. DOI Cheng, Feipeng;Cheng, Jihao;Nan, Yang;Xie, Yuan;Yang, Tongqian;Cheng, Daojian;Zhu, Jiqin;Xu, Haoxiang
    Enhancing oxidative hydration of ethylene towards ethylene glycol over metal-modified titanosilicate catalysts[期刊论文]，Applied Catalysis A: General，2022-08-05
  • 16. DOI Wen, Qi-Xing;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Design of CuCs-doped Ag-based catalyst for ethylene epoxidation[期刊论文]，Chinese Journal of Chemical Physics，2022-08-01
  • 17. DOI 张眉佳,许昊翔,罗一斌,朱吉钦,程道建
    Enhancing the catalytic performance of PdAu catalysts by W induced strong interaction for the direct synthesis of H2O2[期刊论文]，Catalysis Science & Technology，2022-07-26
  • 18. DOI Deng, Zhuoran;Zhou, Yingcheng;Zhao, Liqiang;Cheng, Daojian
    Structures and structural evolution of M-N (M = Pt, Ag, Au, N=2-20) from combined revised particle swarm optimization and density function theory[期刊论文]，MOLECULAR SIMULATION，2022-07-03
  • 19. DOI Zhang, Huimin;Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Carbon-based material-supported single-atom catalysts for energy conversion[期刊论文]，ISCIENCE，2022-06-17
  • 20. DOI 陈志强;车春霞;吴登峰;温翯;韩伟;张峰;许昊翔;程道建
    乙炔选择性加氢催化剂研究进展[期刊论文]，化工进展，2022-03-17
  • 21. DOI Liu, Ning;Cao, Dong;Liu, Wenhao;Zhang, Huimin;Zhu, Yinhai;Chang, Le;Wu, Dengfeng;Cheng, Daojian
    Constructing La-doped ultrathin Co-based nanostructured electrocatalysts for high-performance water oxidation process[期刊论文]，International Journal of Hydrogen Energy，2022-01-01
  • 22. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Branch-leaf-shaped CuNi@NiFeCu nanodendrites as highly efficient electrocatalysts for overall water splitting[期刊论文]，Applied Catalysis B-Environmental，2021-12-05
  • 23. DOI Zhang, Meijia;Luo, Yibin;Wu, Dengfeng;Li, Qian;Xu, Haoxiang;Cheng, Daojian
    Promoter role of tungsten in W-Pd/Al2O3 catalyst for direct synthesis of H2O2: Modification of Pd/PdO ratio[期刊论文]，APPLIED CATALYSIS A-GENERAL，2021-11-25
  • 24. DOI 孙晋冬;展学成;吴登峰;谢元;马好文;许昊翔;程道建
    碳四炔烃选择性加氢催化剂研究进展[期刊论文]，石油学报(石油加工)，2021-10-15
  • 25. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Construction of Dual-Site Atomically Dispersed Electrocatalysts with Ru-C-5 Single Atoms and Ru-O-4 Nanoclusters for Accelerated Alkali Hydrogen Evolution[期刊论文]，Small，2021-08-01
  • 26. DOI Cao, Dong;Wang, Jiayi;Zhang, Huimin;Xu, Haoxiang;Cheng, Daojian
    Growth of IrCu nanoislands with rich IrCu/Ir interfaces enables highly efficient overall water splitting in non-acidic electrolytes[期刊论文]，Chemical Engineering Journal，2021-07-15
  • 27. DOI Zhu, Yinhai;Cao, Dong;Liu, Ning;Cheng, Daojian
    One-step synthesis of atomic Ru doped ultra-thin Co(OH)(2) nanosheets for oxygen evolution reaction in different pH values[期刊论文]，International Journal of Hydrogen Energy，2021-06-28
  • 28. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Metal Dopants in Enhancing the Selectivity of Ag-Catalyzed Ethylene Epoxidation: Optimizing Oxophilicity of Reaction Site via Cocatalytic Mechanism[期刊论文]，ACS Catalysis，2021-03-19
  • 29. DOI 吴建国;吴登峰;程道建
    丙烷脱氢制丙烯用单原子催化剂研究进展[期刊论文]，化工进展，2021-03-16
  • 30. DOI Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Review on Synthesis and Catalytic Coupling Mechanism of Highly Active Electrocatalysts for Water Splitting[期刊论文]，Energy Technology，2021-02-01
  • 31. DOI Ma, Haowen;Xu, Xiaopei;Xu, Haoxiang;Feng, Huixia;Xie, Yuan;Cheng, Daojian
    Understanding composition-dependent catalytic performance of PdAg for the hydrogenation of 1,3-butadiene to 1-butene[期刊论文]，CATALYSIS COMMUNICATIONS，2021-01-15
  • 32. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文]，Advances in Physics-X，2021-01-01
  • 33. DOI Huang, Xingkai;Xu, Haoxiang;Cao, Dong;Cheng, Daojian
    Interface construction of P-Substituted MoS2 as efficient and robust electrocatalyst for alkaline hydrogen evolution reaction[期刊论文]，Nano Energy，2020-12-01
  • 34. DOI Yang, Liu,许昊翔,Liu, Huibing,曾晓飞,程道建,黄燕,Zheng, Lirong,Cao, Rui,曹达鹏
    Oxygen-Reconstituted Active Species of Single-Atom Cu Catalysts for Oxygen Reduction Reaction[期刊论文]，Research，2020-10-05
  • 35. DOI Xu, Xiaopei,许昊翔,程道建
    Identification of the Anti-triangular Etched MoS2 with Comparative Activity with Commercial Pt for Hydrogen Evolution Reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-10-04
  • 36. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Growth of Highly Active Amorphous RuCu Nanosheets on Cu Nanotubes for the Hydrogen Evolution Reaction in Wide pH Values[期刊论文]，Small，2020-09-01
  • 37. DOI 许昊翔,程道建
    First-principles-aided Thermodynamic Modeling of Transition-metal Heterogeneous Catalysts: A review.[期刊论文]，Green Energy & Environment，2020-07-14
  • 38. DOI Xu, Haoxiang;Cheng, Daojian
    First-principles-aided thermodynamic modeling of transition-metal heterogeneous catalysts: A review[期刊论文]，GREEN ENERGY & ENVIRONMENT，2020-07-01
  • 39. DOI Che, Chunxia;Xu, Haoxiang;Wen, He;Gou, Galian;Cheng, Daojian
    Theoretical Study on the Structural, Thermal and Phase Stability of Pt-Cu Alloy Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2020-05-01
  • 40. DOI Zhang, Wei;Zhu, Jiqin;Cheng, Daojian;Zeng, Xiao Cheng
    PtCoNi Alloy Nanoclusters for Synergistic Catalytic Oxygen Reduction Reaction[期刊论文]，ACS APPLIED NANO MATERIALS，2020-03-01
  • 41. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Construction of Defect-Rich RhCu Nanotubes with Highly Active Rh3Cu1 Alloy Phase for Overall Water Splitting in All pH Values[期刊论文]，ADVANCED ENERGY MATERIALS，2020-03-01
  • 42. DOI Wu, Dengfeng;Zhang, Wei;Lin, Aijun;Cheng, Daojian
    Low Pt-Content Ternary PtNiCu Nanoparticles with Hollow Interiors and Accessible Surfaces as Enhanced Multifunctional Electrocatalysts[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2020-02-26
  • 43. DOI Wu, Dengfeng;Yang, Yang;Dai, Changqing;Cheng, Daojian
    Enhanced oxygen reduction activity of PtCu nanoparticles by morphology tuning and transition-metal doping[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-02-07
  • 44. DOI Huang, Xingkai;Xu, Xiaopei;Luan, Xiaoxu;Cheng, Daojian
    CoP nanowires coupled with CoMoP nanosheets as a highly efficient cooperative catalyst for hydrogen evolution reaction[期刊论文]，NANO ENERGY，2020-02-01
  • 45. DOI Zhou, Yingcheng;Zhao, Zheng;Cheng, Daojian
    Cluster structure prediction via revised particle-swarm optimization algorithm[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2020-02-01
  • 46. DOI Li, Lin-Xin;Xie, Zhi-Hui;Fernandez, Carlos;Wu, Liang;Cheng, Daojian;Jiang, Xiao-Hui;Zhong, Chuan-Jian
    Development of a thiophene derivative modified LDH coating for Mg alloy corrosion protection[期刊论文]，ELECTROCHIMICA ACTA，2020-01-10
  • 47. DOI Zhang, Junmeng;Xu, Xiaopei;Yang, Liu;Cheng, Daojian;Cao, Dapeng
    Single-Atom Ru Doping Induced Phase Transition of MoS2 and S Vacancy for Hydrogen Evolution Reaction[期刊论文]，SMALL METHODS，2019-12-11
  • 48. DOI Zhao, Zheng,许昊翔,Feng, Zongyu,Zhang, Yongqi,Cui, Meisheng,曹达鹏,程道建
    Design of High-Performance Co-Based Alloy Nanocatalysts for the Oxygen Reduction Reaction[期刊论文]，Chemistry - A European Journal，2019-12-03
  • 49. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Chlorine in Selectivity Enhancement of Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-11-27
  • 50. DOI Xu, Xiaopei;Xu, Haoxiang;Cheng, Daojian
    Design of high-performance MoS2 edge supported single-metal atom bifunctional catalysts for overall water splitting via a simple equation[期刊论文]，NANOSCALE，2019-11-14
  • 51. DOI Wu, Dengfeng;Cheng, Daojian
    Structure-controlled synthesis of one-dimensional PdCu nanoscatalysts via a seed-mediated approach for oxygen reduction reaction[期刊论文]，APPLIED SURFACE SCIENCE，2019-11-01
  • 52. DOI Huang, Xiaoyu;Yang, Yang;Cheng, Daojian
    Hydrogen generation from formic acid decomposition on Pd-Cu nanoalloys[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-09-13
  • 53. DOI Zhang, Wei;Deibert, David L.;Cheng, Daojian;Zeng, Xiao Cheng
    Magnetism in bimetallic PtxNiN-x clusters via cross-atomic coupling[期刊论文]，JOURNAL OF MATERIALS CHEMISTRY C，2019-08-14
  • 54. DOI Ma, Haowen;Yang, Yang;Feng, Huixia;Cheng, Daojian
    DFT Study of Pyrolysis Gasoline Hydrogenation on Pd(100), Pd(110) and Pd(111) Surfaces[期刊论文]，CATALYSIS LETTERS，2019-08-01
  • 55. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Fortunelli, Alessandro;Cheng, Daojian
    Selectivity-Driven Design of the Ag-Cu Alloys for the Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-07-24
  • 56. DOI Cao, Dong;Cheng, Daojian
    One-pot synthesis of copper-nickel sulfide nanowires for overall water splitting in alkaline media[期刊论文]，CHEMICAL COMMUNICATIONS，2019-07-18
  • 57. DOI Huang, Xingkai;Xu, Xiaopei;Li, Chao;Wu, Dengfeng;Cheng, Daojian;Cao, Dapeng
    Vertical CoP Nanoarray Wrapped by N,P-Doped Carbon for Hydrogen Evolution Reaction in Both Acidic and Alkaline Conditions[期刊论文]，ADVANCED ENERGY MATERIALS，2019-06-01
  • 58. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Cheng, Daojian
    The synergistic effect between crystal planes and promoters on Ag-catalyzed ethylene epoxidation[期刊论文]，APPLIED SURFACE SCIENCE，2019-05-15
  • 59. DOI Yang, Liu;Xu, Haoxiang;Liu, Huibing;Cheng, Daojian;Cao, Dapeng
    Active Site Identification and Evaluation Criteria of In Situ Grown CoTe and NiTe Nanoarrays for Hydrogen Evolution and Oxygen Evolution Reactions[期刊论文]，SMALL METHODS，2019-05-10
  • 60. DOI Yang, Chenxi;Wang, Guoqing;Liang, Aimin;Yue, Yi;Peng, Hui;Cheng, Daojian
    Understanding the role of Au in the selective hydrogenation of acetylene on trimetallic PdAgAu catalytic surface[期刊论文]，CATALYSIS COMMUNICATIONS，2019-05-05
  • 61. DOI Li, Pengcheng;Wu, Dengfeng;Dai, Changqing;Huang, Xingkai;Li, Chao;Yin, Zhen;Zhou, Song;Lv, Zhengang;Cheng, Daojian;Zhu, Jiqin;Xu, Jian;Liu, Xi
    Controlled Synthesis of Copper-Doped Molybdenum Carbide Catalyst with Enhanced Activity and Stability for Hydrogen Evolution Reaction[期刊论文]，CATALYSIS LETTERS，2019-05-01
  • 62. DOI Elouarzaki Kamal,Wang Yian,Kannan Vishvak,许昊翔,程道建,Lee Jong-Min,Fisher Adrian C.
    Hydrogenase-Like Electrocatalytic Activation and Inactivation Mechanism by Three-Dimensional Binderless Molecular Catalyst[期刊论文]，ACS Applied Energy Materials，2019-04-09
  • 63. DOI Xu, Haoxiang;Cheng, Daojian
    Rational design of transition metal nanocatalyst by structure descriptor[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2019-03-31
  • 64. DOI Yang, Mengjie;Wu, Dengfeng;Cheng, Daojian
    Biomass-derived porous carbon supported Co-CoO yolk-shell nanoparticles as enhanced multifunctional electrocatalysts[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-03-08
  • 65. DOI Zhao, Zheng;Kong, Kewei;Wang, Shixian;Zhou, Yingcheng;Cheng, Daojian;Wang, Wenchuan;Zeng, Xiao Cheng;Li, Hui
    Understanding Hygroscopic Nucleation of Sulfate Aerosols: Combination of Molecular Dynamics Simulation with Classical Nucleation Theory[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY LETTERS，2019-03-07
  • 66. DOI Lv, Yanlong,朱琳,许昊翔,Yang, Liu,刘志平,程道建,Cao, Xiaohua,Yun Jimmy,曹达鹏
    Core/shell Template-derived Co, N-doped Carbon Bifunctional Electrocatalysts for Rechargeable Zn-air Battery[期刊论文]，Engineered Science，2019-02-28
  • 67. DOI Zhao, Zheng;Xu, Haoxiang;Gao, Yi;Cheng, Daojian
    Universal description of heating-induced reshaping preference of core-shell bimetallic nanoparticles[期刊论文]，NANOSCALE，2019-01-21
  • 68. DOI Yang, Yang,Zhao, Zheng,程道建,朱吉钦
    Effect of Size and Composition on the Structural Stability of Pt–Ni Nanoalloys[期刊论文]，Journal of Cluster Science，2019-01-14
  • 69. DOI Nan, Yang;Wang, Yinuo;Cao, Dong;Yang, Yang;Cheng, Daojian
    Adsorption and dissociation of borohydride on different Ir-Ni alloy surfaces[期刊论文]，Appl Surf Sci，2019-01-01
  • 70. DOI Yang, Yang,许昊翔,曹达鹏,曾晓成,程道建
    Hydrogen Production via Efficient Formic Acid Decomposition: Engineering the Surface Structure of Pd-Based Alloy Catalysts by Design[期刊论文]，ACS Catalysis，2018-12-07
  • 71. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Zhu, Jiqin;Cheng, Daojian
    Facet-dependent diffusion of atomic oxygen on Ag surfaces[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2018-12-01
  • 72. DOI Chang, Le;Cheng, Daojian;Sementa, Luca;Fortunelli, Alessandro
    Hydrogen evolution reaction (HER) on Au@Ag ultrananoclusters as electro-catalysts[期刊论文]，NANOSCALE，2018-10-07
  • 73. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi;Zeng, Xiao Cheng
    Assessment of Catalytic Activities of Gold Nanoclusters with Simple Structure Descriptors[期刊论文]，ACS CATALYSIS，2018-10-01
  • 74. DOI Yang, Yang;Dai, Changqing;Wu, Dengfeng;Liu, Zhiping;Cheng, Daojian
    The Size Effect of PdCu Bimetallic Nanoparticles on Oxygen Reduction Reaction Activity[期刊论文]，CHEMELECTROCHEM，2018-09-12
  • 75. DOI Lian, Xiaojun;Niu, Mang;Huang, Yan;Cheng, Daojian
    MoS2-CdS heterojunction with enhanced photocatalytic activity: A first principles study[期刊论文]，JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS，2018-09-01
  • 76. DOI Huang, Yichao;Hu, Jun;Xu, Haoxiang;Bian, Wei;Ge, Jingxuan;Zang, Dejin;Cheng, Daojian;Lv, Yaokang;Zhang, Cheng;Gu, Jing;Wei, Yongge
    Fine Tuning Electronic Structure of Catalysts through Atomic Engineering for Enhanced Hydrogen Evolution[期刊论文]，ADVANCED ENERGY MATERIALS，2018-08-27
  • 77. DOI Miao, Xue-Pei;Cheng, Dao-Jian;Dai, Ya-Dong;Meng, Yan;Li, Xiao-Yu
    Origin of Modulus Improvement for Epoxide-terminated Hyperbranched Poly(ether sulphone)/DGEBA/TETA Systems[期刊论文]，CHINESE JOURNAL OF POLYMER SCIENCE，2018-08-01
  • 78. DOI Chang, Le;Baseggio, Oscar;Sernenta, Luca;Cheng, Daojian;Fronzoni, Giovanna;Toffoli, Daniele;Apra, Edoardo;Stener, Mauro;Fortunelli, Alessandro
    Individual Component Map of Rotatory Strength and Rotatory Strength Density Plots As Analysis Tools of Circular Dichroism Spectra of Complex Systems[期刊论文]，JOURNAL OF CHEMICAL THEORY AND COMPUTATION，2018-07-01
  • 79. DOI Elouarzaki, Kamal;Cheng, Daojian;Fisher, Adrian C.;Lee, Jong-Min
    Coupling orientation and mediation strategies for efficient electron transfer in hybrid biofuel cells[期刊论文]，NATURE ENERGY，2018-07-01
  • 80. DOI Wang, Zegao;Li, Qiang;Xu, Haoxiang;Dahl-Petersen, Christian;Yang, Qian;Cheng, Daojian;Cao, Dapeng;Besenbacher, Flemming;Lauritsen, Jeppe V.;Helveg, Stig;Dong, Mingdong
    Controllable etching of MoS2 basal planes for enhanced hydrogen evolution through the formation of active edge sites[期刊论文]，NANO ENERGY，2018-07-01
  • 81. DOI Yang, Liu;Cheng, Daojian;Zeng, Xiaofei;Wan, Xin;Shui, Jianglan;Xiang, Zhonghua;Cao, Dapeng
    Unveiling the high-activity origin of single-atom iron catalysts for oxygen reduction reaction[期刊论文]，PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA，2018-06-26
  • 82. DOI 杨洋,Yu, Haiyan,Cai, Yushun,Ferrando, Riccardo,程道建
    Origin of enhanced stability and oxygen adsorption capacity of mediumsized Pt–Ni nanoclusters[期刊论文]，Journal of Physics: Condensed Matter，2018-06-22
  • 83. DOI Yu, Haiyan,Yang, Liu,程道建,曹达鹏
    Zeolitic-imidazolate Framework (ZIF)@ZnCo-ZIF Core-shell Template Derived Co, N-doped Carbon Catalysts for Oxygen Reduction Reaction[期刊论文]，Engineered Science，2018-06-02
  • 84. DOI 吴登峰,Zhang, Xin,朱吉钦,程道建
    Concerted Catalysis on Tanghulu-like Cu@Zeolitic Imidazolate Framework-8 (ZIF-8) Nanowires with Tuning Catalytic Performances for 4-nitrophenol Reduction[期刊论文]，Engineered Science，2018-05-21
  • 85. DOI Huang, Yan;Wu, Dengfeng;Cao, Dapeng;Cheng, Daojian
    Facile preparation of biomass-derived bifunctional electrocatalysts for oxygen reduction and evolution reactions[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2018-05-03
  • 86. DOI Xu, Haoxiang;Cheng, Daojian;Cao, Dapeng;Zeng, Xiao Cheng
    A universal principle for a rational design of single-atom electrocatalysts[期刊论文]，NATURE CATALYSIS，2018-05-01
  • 87. DOI Li, Zhenhao;Zhu, Lin;Chen, Jian-Feng;Cheng, Daojian
    Enhanced Ethylene Oxide Selectivity by Cu and Re Dual-Promoted Ag Catalysts[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2018-03-28
  • 88. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian
    Enhanced photochemical performance of hexagonal WO3 by metal-assisted S-O coupling for solar-driven water splitting[期刊论文]，SCIENCE CHINA-MATERIALS，2018-01-01
  • 89. DOI Xu, Haoxiang;Xu, Cong-Qiao;Cheng, Daojian;Li, Jun
    Identification of activity trends for CO oxidation on supported transition-metal single-atom catalysts[期刊论文]，CATALYSIS SCIENCE & TECHNOLOGY，2017-12-21
  • 90. DOI Ren, Dongmei;Cheng, Gang;Li, Jianwei;Li, Jinbing;Dai, Wujun;Sun, XinXin;Cheng, Daojian
    Effect of Rhenium Loading Sequence on Selectivity of Ag-Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-12-01
  • 91. DOI Huang, Xingkai;Wu, Dengfeng;Cheng, Daojian
    Porous Co2P nanowires as high efficient bifunctional catalysts for 4-nitrophenol reduction and sodium borohydride hydrolysis[期刊论文]，JOURNAL OF COLLOID AND INTERFACE SCIENCE，2017-12-01
  • 92. DOI Ren, Dongmei;Xu, Haoxiang;Li, Jianwei;Li, Jinhing;Cheng, Daojian
    Origin of enhanced ethylene oxide selectivity by Cs-promoted silver catalyst[期刊论文]，MOLECULAR CATALYSIS，2017-11-01
  • 93. DOI Wei, Yongsheng;Huang, Xingkai;Wang, Junyan;Yu, Haiyan;Zhao, Xinsheng;Cheng, Daojian
    Synthesis of bifunctional non-noble monolithic catalyst Co-W-P/carbon cloth for sodium borohydride hydrolysis and reduction of 4-nitrophenol[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2017-10-12
  • 94. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 95. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 96. DOI Yan, Bailu;Zhao, Zheng;Zhou, Yingcheng;Yuan, Wenyan;Li, Jian;Wu, Jun;Cheng, Daojian
    A particle swarm optimization algorithm with random learning mechanism and Levy flight for optimization of atomic clusters[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2017-10-01
  • 97. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 98. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 99. DOI Yang, Yang;Dai, Changqing;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    A full understanding of oxygen reduction reaction mechanism on Au(111) surface[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2017-09-13
  • 100. DOI Shan, Aixian;Chen, Chinping;Zhang, Wei;Cheng, Daojian;Shen, Xi;Yu, Richeng;Wang, Rongming
    Giant enhancement and anomalous temperature dependence of magnetism in monodispersed NiPt2 nanoparticles[期刊论文]，NANO RESEARCH，2017-09-01
  • 101. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 102. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 103. DOI Zhang, Xing;Wu, Dengfeng;Cheng, Daojian
    Component-dependent electrocatalytic activity of PdCu bimetallic nanoparticles for hydrogen evolution reaction[期刊论文]，ELECTROCHIMICA ACTA，2017-08-20
  • 104. DOI Zhao, Zheng;Wang, Fang-Hui;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Phase stability and segregation behavior of nickel-based nanoalloys based on theory and simulation[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2017-06-25
  • 105. DOI Wu, Dengfeng;Zhang, Wei;Cheng, Daojian
    Facile Synthesis of Cu/NiCu Electrocatalysts Integrating Alloy, Core Shell, and One-Dimensional Structures for Efficient Methanol Oxidation Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2017-06-14
  • 106. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 107. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 108. DOI Zhang, Wei;Shan, Shiyao;Luo, Jin;Fisher, Adrian;Chen, Jian-Feng;Zhong, Chuan-Jian;Zhu, Jiqin;Chen, Daojian
    Origin of Enhanced Activities for CO Oxidation and O-2 Reaction over Composition-Optimized Pd50Cu50 Nanoalloy Catalysts[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2017-05-25
  • 109. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin;Cheng, Daojian
    Mechanistic insight into the facet-dependent selectivity of ethylene epoxidation on Ag nanocatalysts[期刊论文]，APPLIED CATALYSIS A: GENERAL，2017-05-25
  • 110. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin
    Ni (111)-supported graphene as a potential catalyst for high-efficient CO oxidation[期刊论文]，CARBON，2017-05-01
  • 111. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi
    Design of High-Performance Pd-Based Alloy Nanocatalysts for Direct Synthesis of H2O2[期刊论文]，ACS CATALYSIS，2017-03-01
  • 112. DOI Yu, Haiyan;Cao, Dapeng;Fisher, Adrian;Johnston, Roy L.;Cheng, Daojian
    Size effect on the adsorption and dissociation of CO2 on Co nanoclusters[期刊论文]，APPLIED SURFACE SCIENCE，2017-02-28
  • 113. DOI Lian, Xiaojun;Zhao, Zheng;Cheng, Daojian
    Recent progress on triphenylamine materials: synthesis, properties, and applications[期刊论文]，MOLECULAR CRYSTALS AND LIQUID CRYSTALS，2017-01-01
  • 114. DOI Wu, Dengfeng;Xu, Haoxiang;Cao, Dapeng;Fisher, Adrian;Gao, Yi;Cheng, Daojian
    PdCu alloy nanoparticle-decorated copper nanotubes as enhanced electrocatalysts: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-12-09
  • 115. DOI Dai, Changqing;Yang, Yang;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Interaction of CO2 with metal cluster-functionalized ionic liquids[期刊论文]，JOURNAL OF CO2 UTILIZATION，2016-12-01
  • 116. DOI Wei, Chengcheng;Zhao, Zheng;Fisher, Adrian;Zhu, Jiqin;Cheng, Daojian
    Theoretical Study on the Structures and Thermal Properties of Ag-Pt-Ni Trimetallic Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-11-01
  • 117. DOI Cheng, Daojian;Wu, Dengfeng;Xu, Haoxiang;Fisher, Adrian
    Composition-controlled Synthesis of PtCuNPs Shells on Copper Nanowires as Electrocatalysts[期刊论文]，CHEMISTRYSELECT，2016-09-16
  • 118. DOI Yu, Haiyan;Fisher, Adrian;Cheng, Daojian;Cao, Dapeng
    Cu,N-codoped Hierarchical Porous Carbons as Electrocatalysts for Oxygen Reduction Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2016-08-24
  • 119. DOI Yang, Yang;Dai, Changqing;Shen, Yanchun;Fisher, Adrian;Cheng, Daojian
    Design of binary and ternary platinum shelled electrocatalysts with inexpensive metals for the oxygen reduction reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2016-08-10
  • 120. DOI Liu, Xinyue;Dai, Changqing;Wu, Dengfeng;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Facile Synthesis of PdAgCo Trimetallic Nanoparticles for Formic Acid Electrochemical Oxidation[期刊论文]，CHEMISTRY LETTERS，2016-07-05
  • 121. DOI 程道建
    双金属纳米电催化:理论和实验研究[会议论文]，中国化学会第30届学术年会摘要集-第二十九分会：电化学材料，2016-07-01
  • 122. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    A density functional theory study of sulfur adsorption on Ag-Au nanoalloys[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2016-06-01
  • 123. DOI 程道建
    双金属纳米催化:理论和实验研究[会议论文]，第七届全国物理无机化学学术会议论文集，2016-05-06
  • 124. DOI Zhao, Zheng;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Magnetic Properties of Pt-Based Nanoalloys: A Critical Review[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-05-01
  • 125. DOI Zhao, Zheng;Fisher, Adrian;Cheng, Daojian
    Phase diagram and segregation of Ag-Co nanoalloys: insights from theory and simulation[期刊论文]，NANOTECHNOLOGY，2016-03-18
  • 126. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Huan, Haifeng;Cao, Dapeng
    Enhanced near-infrared shielding ability of (Li, K)-codoped WO3 for smart windows: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-02-09
  • 127. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Highly sensitive and selective colorimetric detection of sulphide using Ag-Au nanoalloys: a DFT study[期刊论文]，RSC ADVANCES，2016-01-01
  • 128. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文]，MOLECULAR SIMULATION，2016-01-01
  • 129. DOI Chang, Le;Liu, Zhiping;Cheng, Daojian
    Optical properties of Ag-Au nanoclusters for sulphide sensing from TDDFT calculations[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2015-12-25
  • 130. DOI Zhang, Wei;Cui, Rong;Wu, Hao;Zhu, Jiqin;Cheng, Daojian
    CO oxidation mechanism on a MgO(100) supported PtxAu3-x clusters[期刊论文]，APPLIED SURFACE SCIENCE，2015-11-30
  • 131. DOI Zhang, Wei;Sumer, Aslihan;Jellinek, Julius;Cheng, Daojian
    Morphology Tailoring of Pt Nanocatalysts for the Oxygen Reduction Reaction: The Paradigm of Pt-13[期刊论文]，CHEMNANOMAT，2015-11-01
  • 132. DOI Wu, Dengfeng;Cheng, Daojian
    Core/shell AgNi/PtAgNi nanoparticles as methanol-tolerant oxygen reduction electrocatalysts[期刊论文]，ELECTROCHIMICA ACTA，2015-10-20
  • 133. DOI wang,qian,fang,yu,孟洪,毋伟,初广文,邹海魁,程道建,陈建峰
    Enhanced simulated sunlight induced photocatalytic activity by pomegranate-like S doped SnO2@TiO2 spheres[期刊论文]，Colloids and Surfaces A: Physicochemical and Engineering Aspects，2015-10-05
  • 134. DOI Niu, Mang;Tan, Huaqiao;Cheng, Daojian;Sun, Zaicheng;Cao, Dapeng
    Bandgap engineering of Magnei phase TinO2n-1: Electron-hole self-compensation[期刊论文]，JOURNAL OF CHEMICAL PHYSICS，2015-08-07
  • 135. DOI Wu, Dengfeng;Dai, Changqing;Li, Shaojie;Cheng, Daojian
    Shape-controlled Synthesis of PdCu Nanocrystals for Formic Acid Oxidation[期刊论文]，CHEMISTRY LETTERS，2015-08-05
  • 136. DOI Niu, Mang;Cui, Rong;Wu, Hao;Cheng, Daojian;Cao, Dapeng
    Enhancement Mechanism of the Conversion Effficiency of Dye-Sensitized Solar Sells Based on Nitrogen-, Fluorine-, and Iodine-Doped TiO2 Photoanodes[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-06-18
  • 137. DOI Yang, Yang;Zhao, Zheng;Cui, Rong;Wu, Hao;Cheng, Daojian
    Structures, Thermal Stability, and Chemical Activity of Crown-Jewel-Structured Pd-Pt Nanoalloys[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-05-21
  • 138. DOI Wang, Jian;Yuan, Wenyan;Cheng, Daojian
    Hybrid genetic-particle swarm algorithm: An efficient method for fast optimization of atomic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2015-05-01
  • 139. DOI Xu, Haoxiang;Cheng, Daojian
    Effect of the Passivating Ligands on the Geometric and Electronic Properties of Au-Pd Nanoalloys[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2015-05-01
  • 140. DOI Chen, Bing;Cheng, Daojian;Zhu, Jiqin
    Synthesis of PtCu nanowires in nonaqueous solvent with enhanced activity and stability for oxygen reduction reaction[期刊论文]，JOURNAL OF POWER SOURCES，2014-12-01
  • 141. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Cao, Dapeng
    Design of the Alkali-Metal-Doped WO3 as a Near-Infrared Shielding Material for Smart Window[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2014-11-19
  • 142. DOI Li, Shaojie;Cheng, Daojian;Qiu, Xiangguo;Cao, Dapeng
    Synthesis of Cu@Pd core-shell nanowires with enhanced activity and stability for formic acid oxidation[期刊论文]，ELECTROCHIMICA ACTA，2014-10-10
  • 143. DOI Chang, Le;Xu, Haoxiang;Cheng, Daojian
    Role of ligand type on the geometric and electronic properties of Ag-Au bimetallic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2014-10-01
  • 144. DOI Zhao, Zheng;Li, Mingjiang;Cheng, Daojian;Zhu, Jiqin
    Understanding the structural properties and thermal stabilities of Au-Pd-Pt trimetallic clustersle[期刊论文]，CHEMICAL PHYSICS，2014-09-30
  • 145. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Fluorite TiO2(111) Surface Phase for Enhanced Visible-Light Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-09-04
  • 146. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    SiH/TiO2 and GeH/TiO2 Heterojunctions: Promising TiO2-based Photocatalysts under Visible Light[期刊论文]，SCIENTIFIC REPORTS，2014-05-02
  • 147. DOI Cheng, Daojian;Xu, Haoxiang;Fortunelli, Alessandro
    Tuning the catalytic activity of Au-Pd nanoalloys in CO oxidation via composition[期刊论文]，JOURNAL OF CATALYSIS，2014-05-01
  • 148. DOI Fang, Yu;Cheng, Daojian;Wu, Wei
    Understanding electronic and optical properties of N-Sn codoped anatase TiO2[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-04-01
  • 149. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding the Mechanism of Photocatalysis Enhancements in the Graphene-like Semiconductor Sheet/TiO2 Composites[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-03-20
  • 150. DOI Cheng, Daojian;Zhang, Minming;Chen, Jianfeng;Yang, Chenxi;Zeng, Xiaofei;Cao, Dapeng
    Computer Screening of Dopants for the Development of New SnO2-Based Transparent Conducting Oxides[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-30
  • 151. DOI Yang, Yang;Cheng, Daojian
    Role of Composition and Geometric Relaxation in CO2 Binding to Cu-Ni Bimetallic Clusters[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-09
  • 152. DOI Zhang, Wei;Cheng, Daojian;Zhu, Jiqin
    Theoretical study of CO catalytic oxidation on free and defective graphene-supported Au-Pd bimetallic clusters[期刊论文]，RSC ADVANCES，2014-01-01
  • 153. DOI Cheng, Daojian;Qiu, Xiangguo;Yu, Haiyan
    Enhancing oxygen reduction reaction activity of Pt-shelled catalysts via subsurface alloying[期刊论文]，PHYSICAL CHEMISTRY CHEMICAL PHYSICS，2014-01-01
  • 154. DOI Tan, Huaqiao;Zhao, Zhao;Niu, Mang;Mao, Chengyu;Cao, Dapeng;Cheng, Daojian;Feng, Pingyun;Sun, Zaicheng
    A facile and versatile method for preparation of colored TiO2 with enhanced solar-driven photocatalytic activity[期刊论文]，NANOSCALE，2014-01-01
  • 155. DOI Li, Mingjiang;Li, Shaojie;Cheng, Daojian
    Influence of adsorbates on the segregation properties of Au-Pd bimetallic clusters[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-01-01
  • 156. DOI Li, Mingjiang;Cheng, Daojian
    Molecular Dynamics Simulation of the Melting Behavior of Crown-Jewel Structured Au-Pd Nanoalloys[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-09-12
  • 157. DOI Cheng, Daojian;Yuan, Shuai;Ferrando, Riccardo
    Structure, chemical ordering and thermal stability of Pt-Ni alloy nanoclusters[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2013-09-04
  • 158. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding Photoelectrochennical Properties of B-N Codoped Anatase TiO2 for Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-08-08
  • 159. DOI Cheng, Daojian;Negreiros, Fabio R.;Apra, Edoardo;Fortunelli, Alessandro
    Computational Approaches to the Chemical Conversion of Carbon Dioxide[期刊论文]，CHEMSUSCHEM，2013-06-01
  • 160. DOI Fang, Yu;Cheng, Daojian;Niu, Mang;Yi, Yongjun;Wu, Wei
    Tailoring the electronic and optical properties of rutile TiO2 by (Nb + Sb, C) codoping from DFT plus U calculations[期刊论文]，CHEMICAL PHYSICS LETTERS，2013-04-19
  • 161. DOI Cheng, Daojian;Cao, Dapeng;Wang, Wenchuan
    Hydrogen storage in porous materials and nanoalloys as catalysts for fuel cell application by using multiscale simulation and experimental methods[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2013-04-07
  • 162. DOI Cheng, Daojian;Jiang, Kun
    Structural stability and kinetics of small carbon clusters on a bimetallic Cu/Ni(111) surface: A first-principles study[期刊论文]，SURFACE SCIENCE，2013-03-01
  • 163. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Enhanced photoelectrochemical performance of anatase TiO2 by metal-assisted S-O coupling for water splitting[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2013-02-06
[+][-] 2023年
  • 1. DOI Zhang, Huimin;Liu, Wenhao;Li, Zhenhao;Qiao, Liang;Chi, Kebin;Guo, Xiaoyan;Cao, Dong;Cheng, Daojian
    Constructing CoP/Ni2P Heterostructure Confined Ru Sub-Nanoclusters for Enhanced Water Splitting in Wide pH Conditions[期刊论文]，Advanced Science，2024-09-18
  • 2. DOI Cao, Dong;Zhang, Zhirong;Cui, Yahui;Zhang, Runhao;Zhang, Lipeng;Zeng, Jie;Cheng, Daojian
    One-Step Approach for Constructing High-Density Single-Atom Catalysts toward Overall Water Splitting at Industrial Current Densities[期刊论文]，Angewandte Chemie-International Edition，2023-02-20
  • 3. DOI Sun, Jindong;Xu, Haoxiang;Ma, Haowen;Zhan, Xuecheng;Zhu, Jiqin;Cheng, Daojian
    Isoprene selective hydrogenation using AgCu-promoted Pd nanoalloys[期刊论文]，FARADAY DISCUSSIONS，2023-01-31
  • 4. DOI Liu, Tianpeng;Liu, Wenhao;Ma, Mengyao;Guo, Linke;Cui, Rong;Cheng, Daojian;Cao, Dong
    Constructing nickel vanadium phosphide nanoarrays with highly active heterointerfaces for water oxidation in alkali media[期刊论文]，ELECTROCHIMICA ACTA，2023-01-20
  • 5. DOI Cao, Dong;Huang, Xiaoyu;Zhang, Huimin;Liu, Wenhao;Cheng, Daojian
    Constructing porous RuCu nanotubes with highly efficient alloy phase for water splitting in different pH conditions[期刊论文]，Chemical Engineering Journal，2023-01-15
  • 6. DOI Wang, Jiayi;Xu, Haoxiang;Che, Chunxia;Zhu, Jiqin;Cheng, Daojian
    Rational Design of PdAg Catalysts for Acetylene Selective Hydrogenation via Structural Descriptor-based Screening Strategy[期刊论文]，ACS Catalysis，2023-01-06
  • 7. DOI Zhang, Huimin;Guo, Xiaoyan;Liu, Wenhao;Wu, Dengfeng;Cao, Dong;Cheng, Daojian
    Regulating surface composition of platinum-copper nanotubes for enhanced hydrogen evolution reaction in all pH values[期刊论文]，Journal of Colloid and Interface Science，2023-01-01
  • 8. DOI Cao, Dong;Shao, Jie;Cui, Yahui;Zhang, Lipeng;Cheng, Daojian
    Interfacial Engineering of Copper–Nickel Selenide Nanodendrites for Enhanced Overall Water Splitting in Alkali Condition[期刊论文]，Small，2023-01-01
  • 9. DOI Wang, Xuning;Xu, Haoxiang;Luo, Yibin;Cheng, Daojian
    High Selective Direct Synthesis of H2O2 over Pd-1@gamma-Al2O3 Single-Atom Catalyst[期刊论文]，CHEMCATCHEM，2022-11-08
  • 10. DOI Deng, Zhuoran;Zhao, Liqiang;Cheng, Daojian
    A high-throughput catalyst synthesis system for Ag-based catalysts[期刊论文]，Review of Scientific Instruments，2022-11-01
  • 11. DOI Xu, Xiaopei;Peng, Zhipeng;Xu, Haoxiang;Cheng, Daojian
    Computational screening of nonmetal dopants to active MoS2 basal-plane for hydrogen evolution reaction via structural descriptor[期刊论文]，Journal of Catalysis，2022-10-31
  • 12. DOI 曹东,许昊翔,Hongliang Li,Chen Feng,Jie Zeng,程道建
    Volcano-type relationship between oxidation states and catalytic activity of single-atom catalysts towards hydrogen evolution[期刊论文]，Nature Communications，2022-10-04
  • 13. DOI Yan, Jingjing;Xu, Haoxiang;Chang, Le;Lin, Aijun;Cheng, Daojian
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single-atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 14. DOI 燕晶晶,许昊翔,常乐,林爱军,程道建
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 15. DOI Cheng, Feipeng;Cheng, Jihao;Nan, Yang;Xie, Yuan;Yang, Tongqian;Cheng, Daojian;Zhu, Jiqin;Xu, Haoxiang
    Enhancing oxidative hydration of ethylene towards ethylene glycol over metal-modified titanosilicate catalysts[期刊论文]，Applied Catalysis A: General，2022-08-05
  • 16. DOI Wen, Qi-Xing;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Design of CuCs-doped Ag-based catalyst for ethylene epoxidation[期刊论文]，Chinese Journal of Chemical Physics，2022-08-01
  • 17. DOI 张眉佳,许昊翔,罗一斌,朱吉钦,程道建
    Enhancing the catalytic performance of PdAu catalysts by W induced strong interaction for the direct synthesis of H2O2[期刊论文]，Catalysis Science & Technology，2022-07-26
  • 18. DOI Deng, Zhuoran;Zhou, Yingcheng;Zhao, Liqiang;Cheng, Daojian
    Structures and structural evolution of M-N (M = Pt, Ag, Au, N=2-20) from combined revised particle swarm optimization and density function theory[期刊论文]，MOLECULAR SIMULATION，2022-07-03
  • 19. DOI Zhang, Huimin;Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Carbon-based material-supported single-atom catalysts for energy conversion[期刊论文]，ISCIENCE，2022-06-17
  • 20. DOI 陈志强;车春霞;吴登峰;温翯;韩伟;张峰;许昊翔;程道建
    乙炔选择性加氢催化剂研究进展[期刊论文]，化工进展，2022-03-17
  • 21. DOI Liu, Ning;Cao, Dong;Liu, Wenhao;Zhang, Huimin;Zhu, Yinhai;Chang, Le;Wu, Dengfeng;Cheng, Daojian
    Constructing La-doped ultrathin Co-based nanostructured electrocatalysts for high-performance water oxidation process[期刊论文]，International Journal of Hydrogen Energy，2022-01-01
  • 22. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Branch-leaf-shaped CuNi@NiFeCu nanodendrites as highly efficient electrocatalysts for overall water splitting[期刊论文]，Applied Catalysis B-Environmental，2021-12-05
  • 23. DOI Zhang, Meijia;Luo, Yibin;Wu, Dengfeng;Li, Qian;Xu, Haoxiang;Cheng, Daojian
    Promoter role of tungsten in W-Pd/Al2O3 catalyst for direct synthesis of H2O2: Modification of Pd/PdO ratio[期刊论文]，APPLIED CATALYSIS A-GENERAL，2021-11-25
  • 24. DOI 孙晋冬;展学成;吴登峰;谢元;马好文;许昊翔;程道建
    碳四炔烃选择性加氢催化剂研究进展[期刊论文]，石油学报(石油加工)，2021-10-15
  • 25. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Construction of Dual-Site Atomically Dispersed Electrocatalysts with Ru-C-5 Single Atoms and Ru-O-4 Nanoclusters for Accelerated Alkali Hydrogen Evolution[期刊论文]，Small，2021-08-01
  • 26. DOI Cao, Dong;Wang, Jiayi;Zhang, Huimin;Xu, Haoxiang;Cheng, Daojian
    Growth of IrCu nanoislands with rich IrCu/Ir interfaces enables highly efficient overall water splitting in non-acidic electrolytes[期刊论文]，Chemical Engineering Journal，2021-07-15
  • 27. DOI Zhu, Yinhai;Cao, Dong;Liu, Ning;Cheng, Daojian
    One-step synthesis of atomic Ru doped ultra-thin Co(OH)(2) nanosheets for oxygen evolution reaction in different pH values[期刊论文]，International Journal of Hydrogen Energy，2021-06-28
  • 28. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Metal Dopants in Enhancing the Selectivity of Ag-Catalyzed Ethylene Epoxidation: Optimizing Oxophilicity of Reaction Site via Cocatalytic Mechanism[期刊论文]，ACS Catalysis，2021-03-19
  • 29. DOI 吴建国;吴登峰;程道建
    丙烷脱氢制丙烯用单原子催化剂研究进展[期刊论文]，化工进展，2021-03-16
  • 30. DOI Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Review on Synthesis and Catalytic Coupling Mechanism of Highly Active Electrocatalysts for Water Splitting[期刊论文]，Energy Technology，2021-02-01
  • 31. DOI Ma, Haowen;Xu, Xiaopei;Xu, Haoxiang;Feng, Huixia;Xie, Yuan;Cheng, Daojian
    Understanding composition-dependent catalytic performance of PdAg for the hydrogenation of 1,3-butadiene to 1-butene[期刊论文]，CATALYSIS COMMUNICATIONS，2021-01-15
  • 32. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文]，Advances in Physics-X，2021-01-01
  • 33. DOI Huang, Xingkai;Xu, Haoxiang;Cao, Dong;Cheng, Daojian
    Interface construction of P-Substituted MoS2 as efficient and robust electrocatalyst for alkaline hydrogen evolution reaction[期刊论文]，Nano Energy，2020-12-01
  • 34. DOI Yang, Liu,许昊翔,Liu, Huibing,曾晓飞,程道建,黄燕,Zheng, Lirong,Cao, Rui,曹达鹏
    Oxygen-Reconstituted Active Species of Single-Atom Cu Catalysts for Oxygen Reduction Reaction[期刊论文]，Research，2020-10-05
  • 35. DOI Xu, Xiaopei,许昊翔,程道建
    Identification of the Anti-triangular Etched MoS2 with Comparative Activity with Commercial Pt for Hydrogen Evolution Reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-10-04
  • 36. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Growth of Highly Active Amorphous RuCu Nanosheets on Cu Nanotubes for the Hydrogen Evolution Reaction in Wide pH Values[期刊论文]，Small，2020-09-01
  • 37. DOI 许昊翔,程道建
    First-principles-aided Thermodynamic Modeling of Transition-metal Heterogeneous Catalysts: A review.[期刊论文]，Green Energy & Environment，2020-07-14
  • 38. DOI Xu, Haoxiang;Cheng, Daojian
    First-principles-aided thermodynamic modeling of transition-metal heterogeneous catalysts: A review[期刊论文]，GREEN ENERGY & ENVIRONMENT，2020-07-01
  • 39. DOI Che, Chunxia;Xu, Haoxiang;Wen, He;Gou, Galian;Cheng, Daojian
    Theoretical Study on the Structural, Thermal and Phase Stability of Pt-Cu Alloy Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2020-05-01
  • 40. DOI Zhang, Wei;Zhu, Jiqin;Cheng, Daojian;Zeng, Xiao Cheng
    PtCoNi Alloy Nanoclusters for Synergistic Catalytic Oxygen Reduction Reaction[期刊论文]，ACS APPLIED NANO MATERIALS，2020-03-01
  • 41. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Construction of Defect-Rich RhCu Nanotubes with Highly Active Rh3Cu1 Alloy Phase for Overall Water Splitting in All pH Values[期刊论文]，ADVANCED ENERGY MATERIALS，2020-03-01
  • 42. DOI Wu, Dengfeng;Zhang, Wei;Lin, Aijun;Cheng, Daojian
    Low Pt-Content Ternary PtNiCu Nanoparticles with Hollow Interiors and Accessible Surfaces as Enhanced Multifunctional Electrocatalysts[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2020-02-26
  • 43. DOI Wu, Dengfeng;Yang, Yang;Dai, Changqing;Cheng, Daojian
    Enhanced oxygen reduction activity of PtCu nanoparticles by morphology tuning and transition-metal doping[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-02-07
  • 44. DOI Huang, Xingkai;Xu, Xiaopei;Luan, Xiaoxu;Cheng, Daojian
    CoP nanowires coupled with CoMoP nanosheets as a highly efficient cooperative catalyst for hydrogen evolution reaction[期刊论文]，NANO ENERGY，2020-02-01
  • 45. DOI Zhou, Yingcheng;Zhao, Zheng;Cheng, Daojian
    Cluster structure prediction via revised particle-swarm optimization algorithm[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2020-02-01
  • 46. DOI Li, Lin-Xin;Xie, Zhi-Hui;Fernandez, Carlos;Wu, Liang;Cheng, Daojian;Jiang, Xiao-Hui;Zhong, Chuan-Jian
    Development of a thiophene derivative modified LDH coating for Mg alloy corrosion protection[期刊论文]，ELECTROCHIMICA ACTA，2020-01-10
  • 47. DOI Zhang, Junmeng;Xu, Xiaopei;Yang, Liu;Cheng, Daojian;Cao, Dapeng
    Single-Atom Ru Doping Induced Phase Transition of MoS2 and S Vacancy for Hydrogen Evolution Reaction[期刊论文]，SMALL METHODS，2019-12-11
  • 48. DOI Zhao, Zheng,许昊翔,Feng, Zongyu,Zhang, Yongqi,Cui, Meisheng,曹达鹏,程道建
    Design of High-Performance Co-Based Alloy Nanocatalysts for the Oxygen Reduction Reaction[期刊论文]，Chemistry - A European Journal，2019-12-03
  • 49. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Chlorine in Selectivity Enhancement of Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-11-27
  • 50. DOI Xu, Xiaopei;Xu, Haoxiang;Cheng, Daojian
    Design of high-performance MoS2 edge supported single-metal atom bifunctional catalysts for overall water splitting via a simple equation[期刊论文]，NANOSCALE，2019-11-14
  • 51. DOI Wu, Dengfeng;Cheng, Daojian
    Structure-controlled synthesis of one-dimensional PdCu nanoscatalysts via a seed-mediated approach for oxygen reduction reaction[期刊论文]，APPLIED SURFACE SCIENCE，2019-11-01
  • 52. DOI Huang, Xiaoyu;Yang, Yang;Cheng, Daojian
    Hydrogen generation from formic acid decomposition on Pd-Cu nanoalloys[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-09-13
  • 53. DOI Zhang, Wei;Deibert, David L.;Cheng, Daojian;Zeng, Xiao Cheng
    Magnetism in bimetallic PtxNiN-x clusters via cross-atomic coupling[期刊论文]，JOURNAL OF MATERIALS CHEMISTRY C，2019-08-14
  • 54. DOI Ma, Haowen;Yang, Yang;Feng, Huixia;Cheng, Daojian
    DFT Study of Pyrolysis Gasoline Hydrogenation on Pd(100), Pd(110) and Pd(111) Surfaces[期刊论文]，CATALYSIS LETTERS，2019-08-01
  • 55. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Fortunelli, Alessandro;Cheng, Daojian
    Selectivity-Driven Design of the Ag-Cu Alloys for the Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-07-24
  • 56. DOI Cao, Dong;Cheng, Daojian
    One-pot synthesis of copper-nickel sulfide nanowires for overall water splitting in alkaline media[期刊论文]，CHEMICAL COMMUNICATIONS，2019-07-18
  • 57. DOI Huang, Xingkai;Xu, Xiaopei;Li, Chao;Wu, Dengfeng;Cheng, Daojian;Cao, Dapeng
    Vertical CoP Nanoarray Wrapped by N,P-Doped Carbon for Hydrogen Evolution Reaction in Both Acidic and Alkaline Conditions[期刊论文]，ADVANCED ENERGY MATERIALS，2019-06-01
  • 58. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Cheng, Daojian
    The synergistic effect between crystal planes and promoters on Ag-catalyzed ethylene epoxidation[期刊论文]，APPLIED SURFACE SCIENCE，2019-05-15
  • 59. DOI Yang, Liu;Xu, Haoxiang;Liu, Huibing;Cheng, Daojian;Cao, Dapeng
    Active Site Identification and Evaluation Criteria of In Situ Grown CoTe and NiTe Nanoarrays for Hydrogen Evolution and Oxygen Evolution Reactions[期刊论文]，SMALL METHODS，2019-05-10
  • 60. DOI Yang, Chenxi;Wang, Guoqing;Liang, Aimin;Yue, Yi;Peng, Hui;Cheng, Daojian
    Understanding the role of Au in the selective hydrogenation of acetylene on trimetallic PdAgAu catalytic surface[期刊论文]，CATALYSIS COMMUNICATIONS，2019-05-05
  • 61. DOI Li, Pengcheng;Wu, Dengfeng;Dai, Changqing;Huang, Xingkai;Li, Chao;Yin, Zhen;Zhou, Song;Lv, Zhengang;Cheng, Daojian;Zhu, Jiqin;Xu, Jian;Liu, Xi
    Controlled Synthesis of Copper-Doped Molybdenum Carbide Catalyst with Enhanced Activity and Stability for Hydrogen Evolution Reaction[期刊论文]，CATALYSIS LETTERS，2019-05-01
  • 62. DOI Elouarzaki Kamal,Wang Yian,Kannan Vishvak,许昊翔,程道建,Lee Jong-Min,Fisher Adrian C.
    Hydrogenase-Like Electrocatalytic Activation and Inactivation Mechanism by Three-Dimensional Binderless Molecular Catalyst[期刊论文]，ACS Applied Energy Materials，2019-04-09
  • 63. DOI Xu, Haoxiang;Cheng, Daojian
    Rational design of transition metal nanocatalyst by structure descriptor[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2019-03-31
  • 64. DOI Yang, Mengjie;Wu, Dengfeng;Cheng, Daojian
    Biomass-derived porous carbon supported Co-CoO yolk-shell nanoparticles as enhanced multifunctional electrocatalysts[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-03-08
  • 65. DOI Zhao, Zheng;Kong, Kewei;Wang, Shixian;Zhou, Yingcheng;Cheng, Daojian;Wang, Wenchuan;Zeng, Xiao Cheng;Li, Hui
    Understanding Hygroscopic Nucleation of Sulfate Aerosols: Combination of Molecular Dynamics Simulation with Classical Nucleation Theory[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY LETTERS，2019-03-07
  • 66. DOI Lv, Yanlong,朱琳,许昊翔,Yang, Liu,刘志平,程道建,Cao, Xiaohua,Yun Jimmy,曹达鹏
    Core/shell Template-derived Co, N-doped Carbon Bifunctional Electrocatalysts for Rechargeable Zn-air Battery[期刊论文]，Engineered Science，2019-02-28
  • 67. DOI Zhao, Zheng;Xu, Haoxiang;Gao, Yi;Cheng, Daojian
    Universal description of heating-induced reshaping preference of core-shell bimetallic nanoparticles[期刊论文]，NANOSCALE，2019-01-21
  • 68. DOI Yang, Yang,Zhao, Zheng,程道建,朱吉钦
    Effect of Size and Composition on the Structural Stability of Pt–Ni Nanoalloys[期刊论文]，Journal of Cluster Science，2019-01-14
  • 69. DOI Nan, Yang;Wang, Yinuo;Cao, Dong;Yang, Yang;Cheng, Daojian
    Adsorption and dissociation of borohydride on different Ir-Ni alloy surfaces[期刊论文]，Appl Surf Sci，2019-01-01
  • 70. DOI Yang, Yang,许昊翔,曹达鹏,曾晓成,程道建
    Hydrogen Production via Efficient Formic Acid Decomposition: Engineering the Surface Structure of Pd-Based Alloy Catalysts by Design[期刊论文]，ACS Catalysis，2018-12-07
  • 71. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Zhu, Jiqin;Cheng, Daojian
    Facet-dependent diffusion of atomic oxygen on Ag surfaces[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2018-12-01
  • 72. DOI Chang, Le;Cheng, Daojian;Sementa, Luca;Fortunelli, Alessandro
    Hydrogen evolution reaction (HER) on Au@Ag ultrananoclusters as electro-catalysts[期刊论文]，NANOSCALE，2018-10-07
  • 73. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi;Zeng, Xiao Cheng
    Assessment of Catalytic Activities of Gold Nanoclusters with Simple Structure Descriptors[期刊论文]，ACS CATALYSIS，2018-10-01
  • 74. DOI Yang, Yang;Dai, Changqing;Wu, Dengfeng;Liu, Zhiping;Cheng, Daojian
    The Size Effect of PdCu Bimetallic Nanoparticles on Oxygen Reduction Reaction Activity[期刊论文]，CHEMELECTROCHEM，2018-09-12
  • 75. DOI Lian, Xiaojun;Niu, Mang;Huang, Yan;Cheng, Daojian
    MoS2-CdS heterojunction with enhanced photocatalytic activity: A first principles study[期刊论文]，JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS，2018-09-01
  • 76. DOI Huang, Yichao;Hu, Jun;Xu, Haoxiang;Bian, Wei;Ge, Jingxuan;Zang, Dejin;Cheng, Daojian;Lv, Yaokang;Zhang, Cheng;Gu, Jing;Wei, Yongge
    Fine Tuning Electronic Structure of Catalysts through Atomic Engineering for Enhanced Hydrogen Evolution[期刊论文]，ADVANCED ENERGY MATERIALS，2018-08-27
  • 77. DOI Miao, Xue-Pei;Cheng, Dao-Jian;Dai, Ya-Dong;Meng, Yan;Li, Xiao-Yu
    Origin of Modulus Improvement for Epoxide-terminated Hyperbranched Poly(ether sulphone)/DGEBA/TETA Systems[期刊论文]，CHINESE JOURNAL OF POLYMER SCIENCE，2018-08-01
  • 78. DOI Chang, Le;Baseggio, Oscar;Sernenta, Luca;Cheng, Daojian;Fronzoni, Giovanna;Toffoli, Daniele;Apra, Edoardo;Stener, Mauro;Fortunelli, Alessandro
    Individual Component Map of Rotatory Strength and Rotatory Strength Density Plots As Analysis Tools of Circular Dichroism Spectra of Complex Systems[期刊论文]，JOURNAL OF CHEMICAL THEORY AND COMPUTATION，2018-07-01
  • 79. DOI Elouarzaki, Kamal;Cheng, Daojian;Fisher, Adrian C.;Lee, Jong-Min
    Coupling orientation and mediation strategies for efficient electron transfer in hybrid biofuel cells[期刊论文]，NATURE ENERGY，2018-07-01
  • 80. DOI Wang, Zegao;Li, Qiang;Xu, Haoxiang;Dahl-Petersen, Christian;Yang, Qian;Cheng, Daojian;Cao, Dapeng;Besenbacher, Flemming;Lauritsen, Jeppe V.;Helveg, Stig;Dong, Mingdong
    Controllable etching of MoS2 basal planes for enhanced hydrogen evolution through the formation of active edge sites[期刊论文]，NANO ENERGY，2018-07-01
  • 81. DOI Yang, Liu;Cheng, Daojian;Zeng, Xiaofei;Wan, Xin;Shui, Jianglan;Xiang, Zhonghua;Cao, Dapeng
    Unveiling the high-activity origin of single-atom iron catalysts for oxygen reduction reaction[期刊论文]，PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA，2018-06-26
  • 82. DOI 杨洋,Yu, Haiyan,Cai, Yushun,Ferrando, Riccardo,程道建
    Origin of enhanced stability and oxygen adsorption capacity of mediumsized Pt–Ni nanoclusters[期刊论文]，Journal of Physics: Condensed Matter，2018-06-22
  • 83. DOI Yu, Haiyan,Yang, Liu,程道建,曹达鹏
    Zeolitic-imidazolate Framework (ZIF)@ZnCo-ZIF Core-shell Template Derived Co, N-doped Carbon Catalysts for Oxygen Reduction Reaction[期刊论文]，Engineered Science，2018-06-02
  • 84. DOI 吴登峰,Zhang, Xin,朱吉钦,程道建
    Concerted Catalysis on Tanghulu-like Cu@Zeolitic Imidazolate Framework-8 (ZIF-8) Nanowires with Tuning Catalytic Performances for 4-nitrophenol Reduction[期刊论文]，Engineered Science，2018-05-21
  • 85. DOI Huang, Yan;Wu, Dengfeng;Cao, Dapeng;Cheng, Daojian
    Facile preparation of biomass-derived bifunctional electrocatalysts for oxygen reduction and evolution reactions[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2018-05-03
  • 86. DOI Xu, Haoxiang;Cheng, Daojian;Cao, Dapeng;Zeng, Xiao Cheng
    A universal principle for a rational design of single-atom electrocatalysts[期刊论文]，NATURE CATALYSIS，2018-05-01
  • 87. DOI Li, Zhenhao;Zhu, Lin;Chen, Jian-Feng;Cheng, Daojian
    Enhanced Ethylene Oxide Selectivity by Cu and Re Dual-Promoted Ag Catalysts[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2018-03-28
  • 88. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian
    Enhanced photochemical performance of hexagonal WO3 by metal-assisted S-O coupling for solar-driven water splitting[期刊论文]，SCIENCE CHINA-MATERIALS，2018-01-01
  • 89. DOI Xu, Haoxiang;Xu, Cong-Qiao;Cheng, Daojian;Li, Jun
    Identification of activity trends for CO oxidation on supported transition-metal single-atom catalysts[期刊论文]，CATALYSIS SCIENCE & TECHNOLOGY，2017-12-21
  • 90. DOI Ren, Dongmei;Cheng, Gang;Li, Jianwei;Li, Jinbing;Dai, Wujun;Sun, XinXin;Cheng, Daojian
    Effect of Rhenium Loading Sequence on Selectivity of Ag-Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-12-01
  • 91. DOI Huang, Xingkai;Wu, Dengfeng;Cheng, Daojian
    Porous Co2P nanowires as high efficient bifunctional catalysts for 4-nitrophenol reduction and sodium borohydride hydrolysis[期刊论文]，JOURNAL OF COLLOID AND INTERFACE SCIENCE，2017-12-01
  • 92. DOI Ren, Dongmei;Xu, Haoxiang;Li, Jianwei;Li, Jinhing;Cheng, Daojian
    Origin of enhanced ethylene oxide selectivity by Cs-promoted silver catalyst[期刊论文]，MOLECULAR CATALYSIS，2017-11-01
  • 93. DOI Wei, Yongsheng;Huang, Xingkai;Wang, Junyan;Yu, Haiyan;Zhao, Xinsheng;Cheng, Daojian
    Synthesis of bifunctional non-noble monolithic catalyst Co-W-P/carbon cloth for sodium borohydride hydrolysis and reduction of 4-nitrophenol[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2017-10-12
  • 94. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 95. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 96. DOI Yan, Bailu;Zhao, Zheng;Zhou, Yingcheng;Yuan, Wenyan;Li, Jian;Wu, Jun;Cheng, Daojian
    A particle swarm optimization algorithm with random learning mechanism and Levy flight for optimization of atomic clusters[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2017-10-01
  • 97. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 98. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 99. DOI Yang, Yang;Dai, Changqing;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    A full understanding of oxygen reduction reaction mechanism on Au(111) surface[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2017-09-13
  • 100. DOI Shan, Aixian;Chen, Chinping;Zhang, Wei;Cheng, Daojian;Shen, Xi;Yu, Richeng;Wang, Rongming
    Giant enhancement and anomalous temperature dependence of magnetism in monodispersed NiPt2 nanoparticles[期刊论文]，NANO RESEARCH，2017-09-01
  • 101. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 102. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 103. DOI Zhang, Xing;Wu, Dengfeng;Cheng, Daojian
    Component-dependent electrocatalytic activity of PdCu bimetallic nanoparticles for hydrogen evolution reaction[期刊论文]，ELECTROCHIMICA ACTA，2017-08-20
  • 104. DOI Zhao, Zheng;Wang, Fang-Hui;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Phase stability and segregation behavior of nickel-based nanoalloys based on theory and simulation[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2017-06-25
  • 105. DOI Wu, Dengfeng;Zhang, Wei;Cheng, Daojian
    Facile Synthesis of Cu/NiCu Electrocatalysts Integrating Alloy, Core Shell, and One-Dimensional Structures for Efficient Methanol Oxidation Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2017-06-14
  • 106. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 107. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 108. DOI Zhang, Wei;Shan, Shiyao;Luo, Jin;Fisher, Adrian;Chen, Jian-Feng;Zhong, Chuan-Jian;Zhu, Jiqin;Chen, Daojian
    Origin of Enhanced Activities for CO Oxidation and O-2 Reaction over Composition-Optimized Pd50Cu50 Nanoalloy Catalysts[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2017-05-25
  • 109. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin;Cheng, Daojian
    Mechanistic insight into the facet-dependent selectivity of ethylene epoxidation on Ag nanocatalysts[期刊论文]，APPLIED CATALYSIS A: GENERAL，2017-05-25
  • 110. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin
    Ni (111)-supported graphene as a potential catalyst for high-efficient CO oxidation[期刊论文]，CARBON，2017-05-01
  • 111. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi
    Design of High-Performance Pd-Based Alloy Nanocatalysts for Direct Synthesis of H2O2[期刊论文]，ACS CATALYSIS，2017-03-01
  • 112. DOI Yu, Haiyan;Cao, Dapeng;Fisher, Adrian;Johnston, Roy L.;Cheng, Daojian
    Size effect on the adsorption and dissociation of CO2 on Co nanoclusters[期刊论文]，APPLIED SURFACE SCIENCE，2017-02-28
  • 113. DOI Lian, Xiaojun;Zhao, Zheng;Cheng, Daojian
    Recent progress on triphenylamine materials: synthesis, properties, and applications[期刊论文]，MOLECULAR CRYSTALS AND LIQUID CRYSTALS，2017-01-01
  • 114. DOI Wu, Dengfeng;Xu, Haoxiang;Cao, Dapeng;Fisher, Adrian;Gao, Yi;Cheng, Daojian
    PdCu alloy nanoparticle-decorated copper nanotubes as enhanced electrocatalysts: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-12-09
  • 115. DOI Dai, Changqing;Yang, Yang;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Interaction of CO2 with metal cluster-functionalized ionic liquids[期刊论文]，JOURNAL OF CO2 UTILIZATION，2016-12-01
  • 116. DOI Wei, Chengcheng;Zhao, Zheng;Fisher, Adrian;Zhu, Jiqin;Cheng, Daojian
    Theoretical Study on the Structures and Thermal Properties of Ag-Pt-Ni Trimetallic Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-11-01
  • 117. DOI Cheng, Daojian;Wu, Dengfeng;Xu, Haoxiang;Fisher, Adrian
    Composition-controlled Synthesis of PtCuNPs Shells on Copper Nanowires as Electrocatalysts[期刊论文]，CHEMISTRYSELECT，2016-09-16
  • 118. DOI Yu, Haiyan;Fisher, Adrian;Cheng, Daojian;Cao, Dapeng
    Cu,N-codoped Hierarchical Porous Carbons as Electrocatalysts for Oxygen Reduction Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2016-08-24
  • 119. DOI Yang, Yang;Dai, Changqing;Shen, Yanchun;Fisher, Adrian;Cheng, Daojian
    Design of binary and ternary platinum shelled electrocatalysts with inexpensive metals for the oxygen reduction reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2016-08-10
  • 120. DOI Liu, Xinyue;Dai, Changqing;Wu, Dengfeng;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Facile Synthesis of PdAgCo Trimetallic Nanoparticles for Formic Acid Electrochemical Oxidation[期刊论文]，CHEMISTRY LETTERS，2016-07-05
  • 121. DOI 程道建
    双金属纳米电催化:理论和实验研究[会议论文]，中国化学会第30届学术年会摘要集-第二十九分会：电化学材料，2016-07-01
  • 122. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    A density functional theory study of sulfur adsorption on Ag-Au nanoalloys[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2016-06-01
  • 123. DOI 程道建
    双金属纳米催化:理论和实验研究[会议论文]，第七届全国物理无机化学学术会议论文集，2016-05-06
  • 124. DOI Zhao, Zheng;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Magnetic Properties of Pt-Based Nanoalloys: A Critical Review[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-05-01
  • 125. DOI Zhao, Zheng;Fisher, Adrian;Cheng, Daojian
    Phase diagram and segregation of Ag-Co nanoalloys: insights from theory and simulation[期刊论文]，NANOTECHNOLOGY，2016-03-18
  • 126. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Huan, Haifeng;Cao, Dapeng
    Enhanced near-infrared shielding ability of (Li, K)-codoped WO3 for smart windows: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-02-09
  • 127. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Highly sensitive and selective colorimetric detection of sulphide using Ag-Au nanoalloys: a DFT study[期刊论文]，RSC ADVANCES，2016-01-01
  • 128. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文]，MOLECULAR SIMULATION，2016-01-01
  • 129. DOI Chang, Le;Liu, Zhiping;Cheng, Daojian
    Optical properties of Ag-Au nanoclusters for sulphide sensing from TDDFT calculations[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2015-12-25
  • 130. DOI Zhang, Wei;Cui, Rong;Wu, Hao;Zhu, Jiqin;Cheng, Daojian
    CO oxidation mechanism on a MgO(100) supported PtxAu3-x clusters[期刊论文]，APPLIED SURFACE SCIENCE，2015-11-30
  • 131. DOI Zhang, Wei;Sumer, Aslihan;Jellinek, Julius;Cheng, Daojian
    Morphology Tailoring of Pt Nanocatalysts for the Oxygen Reduction Reaction: The Paradigm of Pt-13[期刊论文]，CHEMNANOMAT，2015-11-01
  • 132. DOI Wu, Dengfeng;Cheng, Daojian
    Core/shell AgNi/PtAgNi nanoparticles as methanol-tolerant oxygen reduction electrocatalysts[期刊论文]，ELECTROCHIMICA ACTA，2015-10-20
  • 133. DOI wang,qian,fang,yu,孟洪,毋伟,初广文,邹海魁,程道建,陈建峰
    Enhanced simulated sunlight induced photocatalytic activity by pomegranate-like S doped SnO2@TiO2 spheres[期刊论文]，Colloids and Surfaces A: Physicochemical and Engineering Aspects，2015-10-05
  • 134. DOI Niu, Mang;Tan, Huaqiao;Cheng, Daojian;Sun, Zaicheng;Cao, Dapeng
    Bandgap engineering of Magnei phase TinO2n-1: Electron-hole self-compensation[期刊论文]，JOURNAL OF CHEMICAL PHYSICS，2015-08-07
  • 135. DOI Wu, Dengfeng;Dai, Changqing;Li, Shaojie;Cheng, Daojian
    Shape-controlled Synthesis of PdCu Nanocrystals for Formic Acid Oxidation[期刊论文]，CHEMISTRY LETTERS，2015-08-05
  • 136. DOI Niu, Mang;Cui, Rong;Wu, Hao;Cheng, Daojian;Cao, Dapeng
    Enhancement Mechanism of the Conversion Effficiency of Dye-Sensitized Solar Sells Based on Nitrogen-, Fluorine-, and Iodine-Doped TiO2 Photoanodes[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-06-18
  • 137. DOI Yang, Yang;Zhao, Zheng;Cui, Rong;Wu, Hao;Cheng, Daojian
    Structures, Thermal Stability, and Chemical Activity of Crown-Jewel-Structured Pd-Pt Nanoalloys[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-05-21
  • 138. DOI Wang, Jian;Yuan, Wenyan;Cheng, Daojian
    Hybrid genetic-particle swarm algorithm: An efficient method for fast optimization of atomic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2015-05-01
  • 139. DOI Xu, Haoxiang;Cheng, Daojian
    Effect of the Passivating Ligands on the Geometric and Electronic Properties of Au-Pd Nanoalloys[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2015-05-01
  • 140. DOI Chen, Bing;Cheng, Daojian;Zhu, Jiqin
    Synthesis of PtCu nanowires in nonaqueous solvent with enhanced activity and stability for oxygen reduction reaction[期刊论文]，JOURNAL OF POWER SOURCES，2014-12-01
  • 141. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Cao, Dapeng
    Design of the Alkali-Metal-Doped WO3 as a Near-Infrared Shielding Material for Smart Window[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2014-11-19
  • 142. DOI Li, Shaojie;Cheng, Daojian;Qiu, Xiangguo;Cao, Dapeng
    Synthesis of Cu@Pd core-shell nanowires with enhanced activity and stability for formic acid oxidation[期刊论文]，ELECTROCHIMICA ACTA，2014-10-10
  • 143. DOI Chang, Le;Xu, Haoxiang;Cheng, Daojian
    Role of ligand type on the geometric and electronic properties of Ag-Au bimetallic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2014-10-01
  • 144. DOI Zhao, Zheng;Li, Mingjiang;Cheng, Daojian;Zhu, Jiqin
    Understanding the structural properties and thermal stabilities of Au-Pd-Pt trimetallic clustersle[期刊论文]，CHEMICAL PHYSICS，2014-09-30
  • 145. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Fluorite TiO2(111) Surface Phase for Enhanced Visible-Light Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-09-04
  • 146. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    SiH/TiO2 and GeH/TiO2 Heterojunctions: Promising TiO2-based Photocatalysts under Visible Light[期刊论文]，SCIENTIFIC REPORTS，2014-05-02
  • 147. DOI Cheng, Daojian;Xu, Haoxiang;Fortunelli, Alessandro
    Tuning the catalytic activity of Au-Pd nanoalloys in CO oxidation via composition[期刊论文]，JOURNAL OF CATALYSIS，2014-05-01
  • 148. DOI Fang, Yu;Cheng, Daojian;Wu, Wei
    Understanding electronic and optical properties of N-Sn codoped anatase TiO2[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-04-01
  • 149. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding the Mechanism of Photocatalysis Enhancements in the Graphene-like Semiconductor Sheet/TiO2 Composites[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-03-20
  • 150. DOI Cheng, Daojian;Zhang, Minming;Chen, Jianfeng;Yang, Chenxi;Zeng, Xiaofei;Cao, Dapeng
    Computer Screening of Dopants for the Development of New SnO2-Based Transparent Conducting Oxides[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-30
  • 151. DOI Yang, Yang;Cheng, Daojian
    Role of Composition and Geometric Relaxation in CO2 Binding to Cu-Ni Bimetallic Clusters[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-09
  • 152. DOI Zhang, Wei;Cheng, Daojian;Zhu, Jiqin
    Theoretical study of CO catalytic oxidation on free and defective graphene-supported Au-Pd bimetallic clusters[期刊论文]，RSC ADVANCES，2014-01-01
  • 153. DOI Cheng, Daojian;Qiu, Xiangguo;Yu, Haiyan
    Enhancing oxygen reduction reaction activity of Pt-shelled catalysts via subsurface alloying[期刊论文]，PHYSICAL CHEMISTRY CHEMICAL PHYSICS，2014-01-01
  • 154. DOI Tan, Huaqiao;Zhao, Zhao;Niu, Mang;Mao, Chengyu;Cao, Dapeng;Cheng, Daojian;Feng, Pingyun;Sun, Zaicheng
    A facile and versatile method for preparation of colored TiO2 with enhanced solar-driven photocatalytic activity[期刊论文]，NANOSCALE，2014-01-01
  • 155. DOI Li, Mingjiang;Li, Shaojie;Cheng, Daojian
    Influence of adsorbates on the segregation properties of Au-Pd bimetallic clusters[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-01-01
  • 156. DOI Li, Mingjiang;Cheng, Daojian
    Molecular Dynamics Simulation of the Melting Behavior of Crown-Jewel Structured Au-Pd Nanoalloys[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-09-12
  • 157. DOI Cheng, Daojian;Yuan, Shuai;Ferrando, Riccardo
    Structure, chemical ordering and thermal stability of Pt-Ni alloy nanoclusters[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2013-09-04
  • 158. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding Photoelectrochennical Properties of B-N Codoped Anatase TiO2 for Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-08-08
  • 159. DOI Cheng, Daojian;Negreiros, Fabio R.;Apra, Edoardo;Fortunelli, Alessandro
    Computational Approaches to the Chemical Conversion of Carbon Dioxide[期刊论文]，CHEMSUSCHEM，2013-06-01
  • 160. DOI Fang, Yu;Cheng, Daojian;Niu, Mang;Yi, Yongjun;Wu, Wei
    Tailoring the electronic and optical properties of rutile TiO2 by (Nb + Sb, C) codoping from DFT plus U calculations[期刊论文]，CHEMICAL PHYSICS LETTERS，2013-04-19
  • 161. DOI Cheng, Daojian;Cao, Dapeng;Wang, Wenchuan
    Hydrogen storage in porous materials and nanoalloys as catalysts for fuel cell application by using multiscale simulation and experimental methods[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2013-04-07
  • 162. DOI Cheng, Daojian;Jiang, Kun
    Structural stability and kinetics of small carbon clusters on a bimetallic Cu/Ni(111) surface: A first-principles study[期刊论文]，SURFACE SCIENCE，2013-03-01
  • 163. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Enhanced photoelectrochemical performance of anatase TiO2 by metal-assisted S-O coupling for water splitting[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2013-02-06
[+][-]2023年之前
  • 1. DOI Zhang, Huimin;Liu, Wenhao;Li, Zhenhao;Qiao, Liang;Chi, Kebin;Guo, Xiaoyan;Cao, Dong;Cheng, Daojian
    Constructing CoP/Ni2P Heterostructure Confined Ru Sub-Nanoclusters for Enhanced Water Splitting in Wide pH Conditions[期刊论文]，Advanced Science，2024-09-18
  • 2. DOI Cao, Dong;Zhang, Zhirong;Cui, Yahui;Zhang, Runhao;Zhang, Lipeng;Zeng, Jie;Cheng, Daojian
    One-Step Approach for Constructing High-Density Single-Atom Catalysts toward Overall Water Splitting at Industrial Current Densities[期刊论文]，Angewandte Chemie-International Edition，2023-02-20
  • 3. DOI Sun, Jindong;Xu, Haoxiang;Ma, Haowen;Zhan, Xuecheng;Zhu, Jiqin;Cheng, Daojian
    Isoprene selective hydrogenation using AgCu-promoted Pd nanoalloys[期刊论文]，FARADAY DISCUSSIONS，2023-01-31
  • 4. DOI Liu, Tianpeng;Liu, Wenhao;Ma, Mengyao;Guo, Linke;Cui, Rong;Cheng, Daojian;Cao, Dong
    Constructing nickel vanadium phosphide nanoarrays with highly active heterointerfaces for water oxidation in alkali media[期刊论文]，ELECTROCHIMICA ACTA，2023-01-20
  • 5. DOI Cao, Dong;Huang, Xiaoyu;Zhang, Huimin;Liu, Wenhao;Cheng, Daojian
    Constructing porous RuCu nanotubes with highly efficient alloy phase for water splitting in different pH conditions[期刊论文]，Chemical Engineering Journal，2023-01-15
  • 6. DOI Wang, Jiayi;Xu, Haoxiang;Che, Chunxia;Zhu, Jiqin;Cheng, Daojian
    Rational Design of PdAg Catalysts for Acetylene Selective Hydrogenation via Structural Descriptor-based Screening Strategy[期刊论文]，ACS Catalysis，2023-01-06
  • 7. DOI Zhang, Huimin;Guo, Xiaoyan;Liu, Wenhao;Wu, Dengfeng;Cao, Dong;Cheng, Daojian
    Regulating surface composition of platinum-copper nanotubes for enhanced hydrogen evolution reaction in all pH values[期刊论文]，Journal of Colloid and Interface Science，2023-01-01
  • 8. DOI Cao, Dong;Shao, Jie;Cui, Yahui;Zhang, Lipeng;Cheng, Daojian
    Interfacial Engineering of Copper–Nickel Selenide Nanodendrites for Enhanced Overall Water Splitting in Alkali Condition[期刊论文]，Small，2023-01-01
  • 9. DOI Wang, Xuning;Xu, Haoxiang;Luo, Yibin;Cheng, Daojian
    High Selective Direct Synthesis of H2O2 over Pd-1@gamma-Al2O3 Single-Atom Catalyst[期刊论文]，CHEMCATCHEM，2022-11-08
  • 10. DOI Deng, Zhuoran;Zhao, Liqiang;Cheng, Daojian
    A high-throughput catalyst synthesis system for Ag-based catalysts[期刊论文]，Review of Scientific Instruments，2022-11-01
  • 11. DOI Xu, Xiaopei;Peng, Zhipeng;Xu, Haoxiang;Cheng, Daojian
    Computational screening of nonmetal dopants to active MoS2 basal-plane for hydrogen evolution reaction via structural descriptor[期刊论文]，Journal of Catalysis，2022-10-31
  • 12. DOI 曹东,许昊翔,Hongliang Li,Chen Feng,Jie Zeng,程道建
    Volcano-type relationship between oxidation states and catalytic activity of single-atom catalysts towards hydrogen evolution[期刊论文]，Nature Communications，2022-10-04
  • 13. DOI Yan, Jingjing;Xu, Haoxiang;Chang, Le;Lin, Aijun;Cheng, Daojian
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single-atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 14. DOI 燕晶晶,许昊翔,常乐,林爱军,程道建
    Revealing the pH-dependent mechanism of nitrate electrochemical reduction to ammonia on single atom catalysts[期刊论文]，Nanoscale，2022-09-19
  • 15. DOI Cheng, Feipeng;Cheng, Jihao;Nan, Yang;Xie, Yuan;Yang, Tongqian;Cheng, Daojian;Zhu, Jiqin;Xu, Haoxiang
    Enhancing oxidative hydration of ethylene towards ethylene glycol over metal-modified titanosilicate catalysts[期刊论文]，Applied Catalysis A: General，2022-08-05
  • 16. DOI Wen, Qi-Xing;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Design of CuCs-doped Ag-based catalyst for ethylene epoxidation[期刊论文]，Chinese Journal of Chemical Physics，2022-08-01
  • 17. DOI 张眉佳,许昊翔,罗一斌,朱吉钦,程道建
    Enhancing the catalytic performance of PdAu catalysts by W induced strong interaction for the direct synthesis of H2O2[期刊论文]，Catalysis Science & Technology，2022-07-26
  • 18. DOI Deng, Zhuoran;Zhou, Yingcheng;Zhao, Liqiang;Cheng, Daojian
    Structures and structural evolution of M-N (M = Pt, Ag, Au, N=2-20) from combined revised particle swarm optimization and density function theory[期刊论文]，MOLECULAR SIMULATION，2022-07-03
  • 19. DOI Zhang, Huimin;Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Carbon-based material-supported single-atom catalysts for energy conversion[期刊论文]，ISCIENCE，2022-06-17
  • 20. DOI 陈志强;车春霞;吴登峰;温翯;韩伟;张峰;许昊翔;程道建
    乙炔选择性加氢催化剂研究进展[期刊论文]，化工进展，2022-03-17
  • 21. DOI Liu, Ning;Cao, Dong;Liu, Wenhao;Zhang, Huimin;Zhu, Yinhai;Chang, Le;Wu, Dengfeng;Cheng, Daojian
    Constructing La-doped ultrathin Co-based nanostructured electrocatalysts for high-performance water oxidation process[期刊论文]，International Journal of Hydrogen Energy，2022-01-01
  • 22. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Branch-leaf-shaped CuNi@NiFeCu nanodendrites as highly efficient electrocatalysts for overall water splitting[期刊论文]，Applied Catalysis B-Environmental，2021-12-05
  • 23. DOI Zhang, Meijia;Luo, Yibin;Wu, Dengfeng;Li, Qian;Xu, Haoxiang;Cheng, Daojian
    Promoter role of tungsten in W-Pd/Al2O3 catalyst for direct synthesis of H2O2: Modification of Pd/PdO ratio[期刊论文]，APPLIED CATALYSIS A-GENERAL，2021-11-25
  • 24. DOI 孙晋冬;展学成;吴登峰;谢元;马好文;许昊翔;程道建
    碳四炔烃选择性加氢催化剂研究进展[期刊论文]，石油学报(石油加工)，2021-10-15
  • 25. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Construction of Dual-Site Atomically Dispersed Electrocatalysts with Ru-C-5 Single Atoms and Ru-O-4 Nanoclusters for Accelerated Alkali Hydrogen Evolution[期刊论文]，Small，2021-08-01
  • 26. DOI Cao, Dong;Wang, Jiayi;Zhang, Huimin;Xu, Haoxiang;Cheng, Daojian
    Growth of IrCu nanoislands with rich IrCu/Ir interfaces enables highly efficient overall water splitting in non-acidic electrolytes[期刊论文]，Chemical Engineering Journal，2021-07-15
  • 27. DOI Zhu, Yinhai;Cao, Dong;Liu, Ning;Cheng, Daojian
    One-step synthesis of atomic Ru doped ultra-thin Co(OH)(2) nanosheets for oxygen evolution reaction in different pH values[期刊论文]，International Journal of Hydrogen Energy，2021-06-28
  • 28. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Metal Dopants in Enhancing the Selectivity of Ag-Catalyzed Ethylene Epoxidation: Optimizing Oxophilicity of Reaction Site via Cocatalytic Mechanism[期刊论文]，ACS Catalysis，2021-03-19
  • 29. DOI 吴建国;吴登峰;程道建
    丙烷脱氢制丙烯用单原子催化剂研究进展[期刊论文]，化工进展，2021-03-16
  • 30. DOI Liu, Wenhao;Cao, Dong;Cheng, Daojian
    Review on Synthesis and Catalytic Coupling Mechanism of Highly Active Electrocatalysts for Water Splitting[期刊论文]，Energy Technology，2021-02-01
  • 31. DOI Ma, Haowen;Xu, Xiaopei;Xu, Haoxiang;Feng, Huixia;Xie, Yuan;Cheng, Daojian
    Understanding composition-dependent catalytic performance of PdAg for the hydrogenation of 1,3-butadiene to 1-butene[期刊论文]，CATALYSIS COMMUNICATIONS，2021-01-15
  • 32. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文]，Advances in Physics-X，2021-01-01
  • 33. DOI Huang, Xingkai;Xu, Haoxiang;Cao, Dong;Cheng, Daojian
    Interface construction of P-Substituted MoS2 as efficient and robust electrocatalyst for alkaline hydrogen evolution reaction[期刊论文]，Nano Energy，2020-12-01
  • 34. DOI Yang, Liu,许昊翔,Liu, Huibing,曾晓飞,程道建,黄燕,Zheng, Lirong,Cao, Rui,曹达鹏
    Oxygen-Reconstituted Active Species of Single-Atom Cu Catalysts for Oxygen Reduction Reaction[期刊论文]，Research，2020-10-05
  • 35. DOI Xu, Xiaopei,许昊翔,程道建
    Identification of the Anti-triangular Etched MoS2 with Comparative Activity with Commercial Pt for Hydrogen Evolution Reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-10-04
  • 36. DOI Cao, Dong;Wang, Jiayi;Xu, Haoxiang;Cheng, Daojian
    Growth of Highly Active Amorphous RuCu Nanosheets on Cu Nanotubes for the Hydrogen Evolution Reaction in Wide pH Values[期刊论文]，Small，2020-09-01
  • 37. DOI 许昊翔,程道建
    First-principles-aided Thermodynamic Modeling of Transition-metal Heterogeneous Catalysts: A review.[期刊论文]，Green Energy & Environment，2020-07-14
  • 38. DOI Xu, Haoxiang;Cheng, Daojian
    First-principles-aided thermodynamic modeling of transition-metal heterogeneous catalysts: A review[期刊论文]，GREEN ENERGY & ENVIRONMENT，2020-07-01
  • 39. DOI Che, Chunxia;Xu, Haoxiang;Wen, He;Gou, Galian;Cheng, Daojian
    Theoretical Study on the Structural, Thermal and Phase Stability of Pt-Cu Alloy Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2020-05-01
  • 40. DOI Zhang, Wei;Zhu, Jiqin;Cheng, Daojian;Zeng, Xiao Cheng
    PtCoNi Alloy Nanoclusters for Synergistic Catalytic Oxygen Reduction Reaction[期刊论文]，ACS APPLIED NANO MATERIALS，2020-03-01
  • 41. DOI Cao, Dong;Xu, Haoxiang;Cheng, Daojian
    Construction of Defect-Rich RhCu Nanotubes with Highly Active Rh3Cu1 Alloy Phase for Overall Water Splitting in All pH Values[期刊论文]，ADVANCED ENERGY MATERIALS，2020-03-01
  • 42. DOI Wu, Dengfeng;Zhang, Wei;Lin, Aijun;Cheng, Daojian
    Low Pt-Content Ternary PtNiCu Nanoparticles with Hollow Interiors and Accessible Surfaces as Enhanced Multifunctional Electrocatalysts[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2020-02-26
  • 43. DOI Wu, Dengfeng;Yang, Yang;Dai, Changqing;Cheng, Daojian
    Enhanced oxygen reduction activity of PtCu nanoparticles by morphology tuning and transition-metal doping[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2020-02-07
  • 44. DOI Huang, Xingkai;Xu, Xiaopei;Luan, Xiaoxu;Cheng, Daojian
    CoP nanowires coupled with CoMoP nanosheets as a highly efficient cooperative catalyst for hydrogen evolution reaction[期刊论文]，NANO ENERGY，2020-02-01
  • 45. DOI Zhou, Yingcheng;Zhao, Zheng;Cheng, Daojian
    Cluster structure prediction via revised particle-swarm optimization algorithm[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2020-02-01
  • 46. DOI Li, Lin-Xin;Xie, Zhi-Hui;Fernandez, Carlos;Wu, Liang;Cheng, Daojian;Jiang, Xiao-Hui;Zhong, Chuan-Jian
    Development of a thiophene derivative modified LDH coating for Mg alloy corrosion protection[期刊论文]，ELECTROCHIMICA ACTA，2020-01-10
  • 47. DOI Zhang, Junmeng;Xu, Xiaopei;Yang, Liu;Cheng, Daojian;Cao, Dapeng
    Single-Atom Ru Doping Induced Phase Transition of MoS2 and S Vacancy for Hydrogen Evolution Reaction[期刊论文]，SMALL METHODS，2019-12-11
  • 48. DOI Zhao, Zheng,许昊翔,Feng, Zongyu,Zhang, Yongqi,Cui, Meisheng,曹达鹏,程道建
    Design of High-Performance Co-Based Alloy Nanocatalysts for the Oxygen Reduction Reaction[期刊论文]，Chemistry - A European Journal，2019-12-03
  • 49. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Cheng, Daojian
    Revisit the Role of Chlorine in Selectivity Enhancement of Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-11-27
  • 50. DOI Xu, Xiaopei;Xu, Haoxiang;Cheng, Daojian
    Design of high-performance MoS2 edge supported single-metal atom bifunctional catalysts for overall water splitting via a simple equation[期刊论文]，NANOSCALE，2019-11-14
  • 51. DOI Wu, Dengfeng;Cheng, Daojian
    Structure-controlled synthesis of one-dimensional PdCu nanoscatalysts via a seed-mediated approach for oxygen reduction reaction[期刊论文]，APPLIED SURFACE SCIENCE，2019-11-01
  • 52. DOI Huang, Xiaoyu;Yang, Yang;Cheng, Daojian
    Hydrogen generation from formic acid decomposition on Pd-Cu nanoalloys[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-09-13
  • 53. DOI Zhang, Wei;Deibert, David L.;Cheng, Daojian;Zeng, Xiao Cheng
    Magnetism in bimetallic PtxNiN-x clusters via cross-atomic coupling[期刊论文]，JOURNAL OF MATERIALS CHEMISTRY C，2019-08-14
  • 54. DOI Ma, Haowen;Yang, Yang;Feng, Huixia;Cheng, Daojian
    DFT Study of Pyrolysis Gasoline Hydrogenation on Pd(100), Pd(110) and Pd(111) Surfaces[期刊论文]，CATALYSIS LETTERS，2019-08-01
  • 55. DOI Xu, Haoxiang;Zhu, Lin;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Fortunelli, Alessandro;Cheng, Daojian
    Selectivity-Driven Design of the Ag-Cu Alloys for the Ethylene Epoxidation[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2019-07-24
  • 56. DOI Cao, Dong;Cheng, Daojian
    One-pot synthesis of copper-nickel sulfide nanowires for overall water splitting in alkaline media[期刊论文]，CHEMICAL COMMUNICATIONS，2019-07-18
  • 57. DOI Huang, Xingkai;Xu, Xiaopei;Li, Chao;Wu, Dengfeng;Cheng, Daojian;Cao, Dapeng
    Vertical CoP Nanoarray Wrapped by N,P-Doped Carbon for Hydrogen Evolution Reaction in Both Acidic and Alkaline Conditions[期刊论文]，ADVANCED ENERGY MATERIALS，2019-06-01
  • 58. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Xie, Yuan;Zhu, Jiqin;Cheng, Daojian
    The synergistic effect between crystal planes and promoters on Ag-catalyzed ethylene epoxidation[期刊论文]，APPLIED SURFACE SCIENCE，2019-05-15
  • 59. DOI Yang, Liu;Xu, Haoxiang;Liu, Huibing;Cheng, Daojian;Cao, Dapeng
    Active Site Identification and Evaluation Criteria of In Situ Grown CoTe and NiTe Nanoarrays for Hydrogen Evolution and Oxygen Evolution Reactions[期刊论文]，SMALL METHODS，2019-05-10
  • 60. DOI Yang, Chenxi;Wang, Guoqing;Liang, Aimin;Yue, Yi;Peng, Hui;Cheng, Daojian
    Understanding the role of Au in the selective hydrogenation of acetylene on trimetallic PdAgAu catalytic surface[期刊论文]，CATALYSIS COMMUNICATIONS，2019-05-05
  • 61. DOI Li, Pengcheng;Wu, Dengfeng;Dai, Changqing;Huang, Xingkai;Li, Chao;Yin, Zhen;Zhou, Song;Lv, Zhengang;Cheng, Daojian;Zhu, Jiqin;Xu, Jian;Liu, Xi
    Controlled Synthesis of Copper-Doped Molybdenum Carbide Catalyst with Enhanced Activity and Stability for Hydrogen Evolution Reaction[期刊论文]，CATALYSIS LETTERS，2019-05-01
  • 62. DOI Elouarzaki Kamal,Wang Yian,Kannan Vishvak,许昊翔,程道建,Lee Jong-Min,Fisher Adrian C.
    Hydrogenase-Like Electrocatalytic Activation and Inactivation Mechanism by Three-Dimensional Binderless Molecular Catalyst[期刊论文]，ACS Applied Energy Materials，2019-04-09
  • 63. DOI Xu, Haoxiang;Cheng, Daojian
    Rational design of transition metal nanocatalyst by structure descriptor[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2019-03-31
  • 64. DOI Yang, Mengjie;Wu, Dengfeng;Cheng, Daojian
    Biomass-derived porous carbon supported Co-CoO yolk-shell nanoparticles as enhanced multifunctional electrocatalysts[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2019-03-08
  • 65. DOI Zhao, Zheng;Kong, Kewei;Wang, Shixian;Zhou, Yingcheng;Cheng, Daojian;Wang, Wenchuan;Zeng, Xiao Cheng;Li, Hui
    Understanding Hygroscopic Nucleation of Sulfate Aerosols: Combination of Molecular Dynamics Simulation with Classical Nucleation Theory[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY LETTERS，2019-03-07
  • 66. DOI Lv, Yanlong,朱琳,许昊翔,Yang, Liu,刘志平,程道建,Cao, Xiaohua,Yun Jimmy,曹达鹏
    Core/shell Template-derived Co, N-doped Carbon Bifunctional Electrocatalysts for Rechargeable Zn-air Battery[期刊论文]，Engineered Science，2019-02-28
  • 67. DOI Zhao, Zheng;Xu, Haoxiang;Gao, Yi;Cheng, Daojian
    Universal description of heating-induced reshaping preference of core-shell bimetallic nanoparticles[期刊论文]，NANOSCALE，2019-01-21
  • 68. DOI Yang, Yang,Zhao, Zheng,程道建,朱吉钦
    Effect of Size and Composition on the Structural Stability of Pt–Ni Nanoalloys[期刊论文]，Journal of Cluster Science，2019-01-14
  • 69. DOI Nan, Yang;Wang, Yinuo;Cao, Dong;Yang, Yang;Cheng, Daojian
    Adsorption and dissociation of borohydride on different Ir-Ni alloy surfaces[期刊论文]，Appl Surf Sci，2019-01-01
  • 70. DOI Yang, Yang,许昊翔,曹达鹏,曾晓成,程道建
    Hydrogen Production via Efficient Formic Acid Decomposition: Engineering the Surface Structure of Pd-Based Alloy Catalysts by Design[期刊论文]，ACS Catalysis，2018-12-07
  • 71. DOI Zhu, Lin;Xu, Haoxiang;Nan, Yang;Zhu, Jiqin;Cheng, Daojian
    Facet-dependent diffusion of atomic oxygen on Ag surfaces[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2018-12-01
  • 72. DOI Chang, Le;Cheng, Daojian;Sementa, Luca;Fortunelli, Alessandro
    Hydrogen evolution reaction (HER) on Au@Ag ultrananoclusters as electro-catalysts[期刊论文]，NANOSCALE，2018-10-07
  • 73. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi;Zeng, Xiao Cheng
    Assessment of Catalytic Activities of Gold Nanoclusters with Simple Structure Descriptors[期刊论文]，ACS CATALYSIS，2018-10-01
  • 74. DOI Yang, Yang;Dai, Changqing;Wu, Dengfeng;Liu, Zhiping;Cheng, Daojian
    The Size Effect of PdCu Bimetallic Nanoparticles on Oxygen Reduction Reaction Activity[期刊论文]，CHEMELECTROCHEM，2018-09-12
  • 75. DOI Lian, Xiaojun;Niu, Mang;Huang, Yan;Cheng, Daojian
    MoS2-CdS heterojunction with enhanced photocatalytic activity: A first principles study[期刊论文]，JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS，2018-09-01
  • 76. DOI Huang, Yichao;Hu, Jun;Xu, Haoxiang;Bian, Wei;Ge, Jingxuan;Zang, Dejin;Cheng, Daojian;Lv, Yaokang;Zhang, Cheng;Gu, Jing;Wei, Yongge
    Fine Tuning Electronic Structure of Catalysts through Atomic Engineering for Enhanced Hydrogen Evolution[期刊论文]，ADVANCED ENERGY MATERIALS，2018-08-27
  • 77. DOI Miao, Xue-Pei;Cheng, Dao-Jian;Dai, Ya-Dong;Meng, Yan;Li, Xiao-Yu
    Origin of Modulus Improvement for Epoxide-terminated Hyperbranched Poly(ether sulphone)/DGEBA/TETA Systems[期刊论文]，CHINESE JOURNAL OF POLYMER SCIENCE，2018-08-01
  • 78. DOI Chang, Le;Baseggio, Oscar;Sernenta, Luca;Cheng, Daojian;Fronzoni, Giovanna;Toffoli, Daniele;Apra, Edoardo;Stener, Mauro;Fortunelli, Alessandro
    Individual Component Map of Rotatory Strength and Rotatory Strength Density Plots As Analysis Tools of Circular Dichroism Spectra of Complex Systems[期刊论文]，JOURNAL OF CHEMICAL THEORY AND COMPUTATION，2018-07-01
  • 79. DOI Elouarzaki, Kamal;Cheng, Daojian;Fisher, Adrian C.;Lee, Jong-Min
    Coupling orientation and mediation strategies for efficient electron transfer in hybrid biofuel cells[期刊论文]，NATURE ENERGY，2018-07-01
  • 80. DOI Wang, Zegao;Li, Qiang;Xu, Haoxiang;Dahl-Petersen, Christian;Yang, Qian;Cheng, Daojian;Cao, Dapeng;Besenbacher, Flemming;Lauritsen, Jeppe V.;Helveg, Stig;Dong, Mingdong
    Controllable etching of MoS2 basal planes for enhanced hydrogen evolution through the formation of active edge sites[期刊论文]，NANO ENERGY，2018-07-01
  • 81. DOI Yang, Liu;Cheng, Daojian;Zeng, Xiaofei;Wan, Xin;Shui, Jianglan;Xiang, Zhonghua;Cao, Dapeng
    Unveiling the high-activity origin of single-atom iron catalysts for oxygen reduction reaction[期刊论文]，PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA，2018-06-26
  • 82. DOI 杨洋,Yu, Haiyan,Cai, Yushun,Ferrando, Riccardo,程道建
    Origin of enhanced stability and oxygen adsorption capacity of mediumsized Pt–Ni nanoclusters[期刊论文]，Journal of Physics: Condensed Matter，2018-06-22
  • 83. DOI Yu, Haiyan,Yang, Liu,程道建,曹达鹏
    Zeolitic-imidazolate Framework (ZIF)@ZnCo-ZIF Core-shell Template Derived Co, N-doped Carbon Catalysts for Oxygen Reduction Reaction[期刊论文]，Engineered Science，2018-06-02
  • 84. DOI 吴登峰,Zhang, Xin,朱吉钦,程道建
    Concerted Catalysis on Tanghulu-like Cu@Zeolitic Imidazolate Framework-8 (ZIF-8) Nanowires with Tuning Catalytic Performances for 4-nitrophenol Reduction[期刊论文]，Engineered Science，2018-05-21
  • 85. DOI Huang, Yan;Wu, Dengfeng;Cao, Dapeng;Cheng, Daojian
    Facile preparation of biomass-derived bifunctional electrocatalysts for oxygen reduction and evolution reactions[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2018-05-03
  • 86. DOI Xu, Haoxiang;Cheng, Daojian;Cao, Dapeng;Zeng, Xiao Cheng
    A universal principle for a rational design of single-atom electrocatalysts[期刊论文]，NATURE CATALYSIS，2018-05-01
  • 87. DOI Li, Zhenhao;Zhu, Lin;Chen, Jian-Feng;Cheng, Daojian
    Enhanced Ethylene Oxide Selectivity by Cu and Re Dual-Promoted Ag Catalysts[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2018-03-28
  • 88. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian
    Enhanced photochemical performance of hexagonal WO3 by metal-assisted S-O coupling for solar-driven water splitting[期刊论文]，SCIENCE CHINA-MATERIALS，2018-01-01
  • 89. DOI Xu, Haoxiang;Xu, Cong-Qiao;Cheng, Daojian;Li, Jun
    Identification of activity trends for CO oxidation on supported transition-metal single-atom catalysts[期刊论文]，CATALYSIS SCIENCE & TECHNOLOGY，2017-12-21
  • 90. DOI Ren, Dongmei;Cheng, Gang;Li, Jianwei;Li, Jinbing;Dai, Wujun;Sun, XinXin;Cheng, Daojian
    Effect of Rhenium Loading Sequence on Selectivity of Ag-Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-12-01
  • 91. DOI Huang, Xingkai;Wu, Dengfeng;Cheng, Daojian
    Porous Co2P nanowires as high efficient bifunctional catalysts for 4-nitrophenol reduction and sodium borohydride hydrolysis[期刊论文]，JOURNAL OF COLLOID AND INTERFACE SCIENCE，2017-12-01
  • 92. DOI Ren, Dongmei;Xu, Haoxiang;Li, Jianwei;Li, Jinhing;Cheng, Daojian
    Origin of enhanced ethylene oxide selectivity by Cs-promoted silver catalyst[期刊论文]，MOLECULAR CATALYSIS，2017-11-01
  • 93. DOI Wei, Yongsheng;Huang, Xingkai;Wang, Junyan;Yu, Haiyan;Zhao, Xinsheng;Cheng, Daojian
    Synthesis of bifunctional non-noble monolithic catalyst Co-W-P/carbon cloth for sodium borohydride hydrolysis and reduction of 4-nitrophenol[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2017-10-12
  • 94. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 95. DOI Ren, Dongmei,Cheng, Gang,李建伟,Li, Jinbing,Dai, Wujun,Sun, XinXin,程道建
    Effect of Rhenium Loading Sequence on Selectivity of Ag–Cs Catalyst for Ethylene Epoxidation[期刊论文]，CATALYSIS LETTERS，2017-10-09
  • 96. DOI Yan, Bailu;Zhao, Zheng;Zhou, Yingcheng;Yuan, Wenyan;Li, Jian;Wu, Jun;Cheng, Daojian
    A particle swarm optimization algorithm with random learning mechanism and Levy flight for optimization of atomic clusters[期刊论文]，COMPUTER PHYSICS COMMUNICATIONS，2017-10-01
  • 97. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 98. DOI Yang, Chenxi,陈建峰,曾晓飞,程道建
    Enhanced photochemical performance of hexagonal WO3 by metalassisted S-O coupling for solar-driven water splitting[期刊论文]，Science China-Materials，2017-09-26
  • 99. DOI Yang, Yang;Dai, Changqing;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    A full understanding of oxygen reduction reaction mechanism on Au(111) surface[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2017-09-13
  • 100. DOI Shan, Aixian;Chen, Chinping;Zhang, Wei;Cheng, Daojian;Shen, Xi;Yu, Richeng;Wang, Rongming
    Giant enhancement and anomalous temperature dependence of magnetism in monodispersed NiPt2 nanoparticles[期刊论文]，NANO RESEARCH，2017-09-01
  • 101. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 102. DOI Yang, Yang,Zheng, Weijie,程道建,曹达鹏
    Designing transition metal and nitrogen-codoped SrTiO3(001) perovskite surfaces as efficient photocatalysts for water splitting[期刊论文]，Sustainable Energy & Fuels，2017-08-26
  • 103. DOI Zhang, Xing;Wu, Dengfeng;Cheng, Daojian
    Component-dependent electrocatalytic activity of PdCu bimetallic nanoparticles for hydrogen evolution reaction[期刊论文]，ELECTROCHIMICA ACTA，2017-08-20
  • 104. DOI Zhao, Zheng;Wang, Fang-Hui;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Phase stability and segregation behavior of nickel-based nanoalloys based on theory and simulation[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2017-06-25
  • 105. DOI Wu, Dengfeng;Zhang, Wei;Cheng, Daojian
    Facile Synthesis of Cu/NiCu Electrocatalysts Integrating Alloy, Core Shell, and One-Dimensional Structures for Efficient Methanol Oxidation Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2017-06-14
  • 106. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 107. DOI Dai, Changqing,Yang, Yang,Zhao, Zheng,Fisher, Adrian,刘志平,程道建
    From mixed to three-layer core/shell PtCu nanoparticles: ligand-induced surface segregation to enhance electrocatalytic activity[期刊论文]，Nanoscale，2017-06-09
  • 108. DOI Zhang, Wei;Shan, Shiyao;Luo, Jin;Fisher, Adrian;Chen, Jian-Feng;Zhong, Chuan-Jian;Zhu, Jiqin;Chen, Daojian
    Origin of Enhanced Activities for CO Oxidation and O-2 Reaction over Composition-Optimized Pd50Cu50 Nanoalloy Catalysts[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2017-05-25
  • 109. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin;Cheng, Daojian
    Mechanistic insight into the facet-dependent selectivity of ethylene epoxidation on Ag nanocatalysts[期刊论文]，APPLIED CATALYSIS A: GENERAL，2017-05-25
  • 110. DOI Zhu, Lin;Zhang, Wei;Zhu, Jiqin
    Ni (111)-supported graphene as a potential catalyst for high-efficient CO oxidation[期刊论文]，CARBON，2017-05-01
  • 111. DOI Xu, Haoxiang;Cheng, Daojian;Gao, Yi
    Design of High-Performance Pd-Based Alloy Nanocatalysts for Direct Synthesis of H2O2[期刊论文]，ACS CATALYSIS，2017-03-01
  • 112. DOI Yu, Haiyan;Cao, Dapeng;Fisher, Adrian;Johnston, Roy L.;Cheng, Daojian
    Size effect on the adsorption and dissociation of CO2 on Co nanoclusters[期刊论文]，APPLIED SURFACE SCIENCE，2017-02-28
  • 113. DOI Lian, Xiaojun;Zhao, Zheng;Cheng, Daojian
    Recent progress on triphenylamine materials: synthesis, properties, and applications[期刊论文]，MOLECULAR CRYSTALS AND LIQUID CRYSTALS，2017-01-01
  • 114. DOI Wu, Dengfeng;Xu, Haoxiang;Cao, Dapeng;Fisher, Adrian;Gao, Yi;Cheng, Daojian
    PdCu alloy nanoparticle-decorated copper nanotubes as enhanced electrocatalysts: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-12-09
  • 115. DOI Dai, Changqing;Yang, Yang;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Interaction of CO2 with metal cluster-functionalized ionic liquids[期刊论文]，JOURNAL OF CO2 UTILIZATION，2016-12-01
  • 116. DOI Wei, Chengcheng;Zhao, Zheng;Fisher, Adrian;Zhu, Jiqin;Cheng, Daojian
    Theoretical Study on the Structures and Thermal Properties of Ag-Pt-Ni Trimetallic Clusters[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-11-01
  • 117. DOI Cheng, Daojian;Wu, Dengfeng;Xu, Haoxiang;Fisher, Adrian
    Composition-controlled Synthesis of PtCuNPs Shells on Copper Nanowires as Electrocatalysts[期刊论文]，CHEMISTRYSELECT，2016-09-16
  • 118. DOI Yu, Haiyan;Fisher, Adrian;Cheng, Daojian;Cao, Dapeng
    Cu,N-codoped Hierarchical Porous Carbons as Electrocatalysts for Oxygen Reduction Reaction[期刊论文]，ACS APPLIED MATERIALS & INTERFACES，2016-08-24
  • 119. DOI Yang, Yang;Dai, Changqing;Shen, Yanchun;Fisher, Adrian;Cheng, Daojian
    Design of binary and ternary platinum shelled electrocatalysts with inexpensive metals for the oxygen reduction reaction[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2016-08-10
  • 120. DOI Liu, Xinyue;Dai, Changqing;Wu, Dengfeng;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Facile Synthesis of PdAgCo Trimetallic Nanoparticles for Formic Acid Electrochemical Oxidation[期刊论文]，CHEMISTRY LETTERS，2016-07-05
  • 121. DOI 程道建
    双金属纳米电催化:理论和实验研究[会议论文]，中国化学会第30届学术年会摘要集-第二十九分会：电化学材料，2016-07-01
  • 122. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    A density functional theory study of sulfur adsorption on Ag-Au nanoalloys[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2016-06-01
  • 123. DOI 程道建
    双金属纳米催化:理论和实验研究[会议论文]，第七届全国物理无机化学学术会议论文集，2016-05-06
  • 124. DOI Zhao, Zheng;Fisher, Adrian;Shen, Yanchun;Cheng, Daojian
    Magnetic Properties of Pt-Based Nanoalloys: A Critical Review[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2016-05-01
  • 125. DOI Zhao, Zheng;Fisher, Adrian;Cheng, Daojian
    Phase diagram and segregation of Ag-Co nanoalloys: insights from theory and simulation[期刊论文]，NANOTECHNOLOGY，2016-03-18
  • 126. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Huan, Haifeng;Cao, Dapeng
    Enhanced near-infrared shielding ability of (Li, K)-codoped WO3 for smart windows: DFT prediction validated by experiment[期刊论文]，NANOTECHNOLOGY，2016-02-09
  • 127. DOI Chang, Le;Fisher, Adrian;Liu, Zhiping;Cheng, Daojian
    Highly sensitive and selective colorimetric detection of sulphide using Ag-Au nanoalloys: a DFT study[期刊论文]，RSC ADVANCES，2016-01-01
  • 128. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文]，MOLECULAR SIMULATION，2016-01-01
  • 129. DOI Chang, Le;Liu, Zhiping;Cheng, Daojian
    Optical properties of Ag-Au nanoclusters for sulphide sensing from TDDFT calculations[期刊论文]，JOURNAL OF ALLOYS AND COMPOUNDS，2015-12-25
  • 130. DOI Zhang, Wei;Cui, Rong;Wu, Hao;Zhu, Jiqin;Cheng, Daojian
    CO oxidation mechanism on a MgO(100) supported PtxAu3-x clusters[期刊论文]，APPLIED SURFACE SCIENCE，2015-11-30
  • 131. DOI Zhang, Wei;Sumer, Aslihan;Jellinek, Julius;Cheng, Daojian
    Morphology Tailoring of Pt Nanocatalysts for the Oxygen Reduction Reaction: The Paradigm of Pt-13[期刊论文]，CHEMNANOMAT，2015-11-01
  • 132. DOI Wu, Dengfeng;Cheng, Daojian
    Core/shell AgNi/PtAgNi nanoparticles as methanol-tolerant oxygen reduction electrocatalysts[期刊论文]，ELECTROCHIMICA ACTA，2015-10-20
  • 133. DOI wang,qian,fang,yu,孟洪,毋伟,初广文,邹海魁,程道建,陈建峰
    Enhanced simulated sunlight induced photocatalytic activity by pomegranate-like S doped SnO2@TiO2 spheres[期刊论文]，Colloids and Surfaces A: Physicochemical and Engineering Aspects，2015-10-05
  • 134. DOI Niu, Mang;Tan, Huaqiao;Cheng, Daojian;Sun, Zaicheng;Cao, Dapeng
    Bandgap engineering of Magnei phase TinO2n-1: Electron-hole self-compensation[期刊论文]，JOURNAL OF CHEMICAL PHYSICS，2015-08-07
  • 135. DOI Wu, Dengfeng;Dai, Changqing;Li, Shaojie;Cheng, Daojian
    Shape-controlled Synthesis of PdCu Nanocrystals for Formic Acid Oxidation[期刊论文]，CHEMISTRY LETTERS，2015-08-05
  • 136. DOI Niu, Mang;Cui, Rong;Wu, Hao;Cheng, Daojian;Cao, Dapeng
    Enhancement Mechanism of the Conversion Effficiency of Dye-Sensitized Solar Sells Based on Nitrogen-, Fluorine-, and Iodine-Doped TiO2 Photoanodes[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-06-18
  • 137. DOI Yang, Yang;Zhao, Zheng;Cui, Rong;Wu, Hao;Cheng, Daojian
    Structures, Thermal Stability, and Chemical Activity of Crown-Jewel-Structured Pd-Pt Nanoalloys[会议论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2015-05-21
  • 138. DOI Wang, Jian;Yuan, Wenyan;Cheng, Daojian
    Hybrid genetic-particle swarm algorithm: An efficient method for fast optimization of atomic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2015-05-01
  • 139. DOI Xu, Haoxiang;Cheng, Daojian
    Effect of the Passivating Ligands on the Geometric and Electronic Properties of Au-Pd Nanoalloys[期刊论文]，JOURNAL OF CLUSTER SCIENCE，2015-05-01
  • 140. DOI Chen, Bing;Cheng, Daojian;Zhu, Jiqin
    Synthesis of PtCu nanowires in nonaqueous solvent with enhanced activity and stability for oxygen reduction reaction[期刊论文]，JOURNAL OF POWER SOURCES，2014-12-01
  • 141. DOI Yang, Chenxi;Chen, Jian-Feng;Zeng, Xiaofei;Cheng, Daojian;Cao, Dapeng
    Design of the Alkali-Metal-Doped WO3 as a Near-Infrared Shielding Material for Smart Window[期刊论文]，INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH，2014-11-19
  • 142. DOI Li, Shaojie;Cheng, Daojian;Qiu, Xiangguo;Cao, Dapeng
    Synthesis of Cu@Pd core-shell nanowires with enhanced activity and stability for formic acid oxidation[期刊论文]，ELECTROCHIMICA ACTA，2014-10-10
  • 143. DOI Chang, Le;Xu, Haoxiang;Cheng, Daojian
    Role of ligand type on the geometric and electronic properties of Ag-Au bimetallic clusters[期刊论文]，COMPUTATIONAL AND THEORETICAL CHEMISTRY，2014-10-01
  • 144. DOI Zhao, Zheng;Li, Mingjiang;Cheng, Daojian;Zhu, Jiqin
    Understanding the structural properties and thermal stabilities of Au-Pd-Pt trimetallic clustersle[期刊论文]，CHEMICAL PHYSICS，2014-09-30
  • 145. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Fluorite TiO2(111) Surface Phase for Enhanced Visible-Light Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-09-04
  • 146. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    SiH/TiO2 and GeH/TiO2 Heterojunctions: Promising TiO2-based Photocatalysts under Visible Light[期刊论文]，SCIENTIFIC REPORTS，2014-05-02
  • 147. DOI Cheng, Daojian;Xu, Haoxiang;Fortunelli, Alessandro
    Tuning the catalytic activity of Au-Pd nanoalloys in CO oxidation via composition[期刊论文]，JOURNAL OF CATALYSIS，2014-05-01
  • 148. DOI Fang, Yu;Cheng, Daojian;Wu, Wei
    Understanding electronic and optical properties of N-Sn codoped anatase TiO2[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-04-01
  • 149. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding the Mechanism of Photocatalysis Enhancements in the Graphene-like Semiconductor Sheet/TiO2 Composites[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-03-20
  • 150. DOI Cheng, Daojian;Zhang, Minming;Chen, Jianfeng;Yang, Chenxi;Zeng, Xiaofei;Cao, Dapeng
    Computer Screening of Dopants for the Development of New SnO2-Based Transparent Conducting Oxides[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-30
  • 151. DOI Yang, Yang;Cheng, Daojian
    Role of Composition and Geometric Relaxation in CO2 Binding to Cu-Ni Bimetallic Clusters[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2014-01-09
  • 152. DOI Zhang, Wei;Cheng, Daojian;Zhu, Jiqin
    Theoretical study of CO catalytic oxidation on free and defective graphene-supported Au-Pd bimetallic clusters[期刊论文]，RSC ADVANCES，2014-01-01
  • 153. DOI Cheng, Daojian;Qiu, Xiangguo;Yu, Haiyan
    Enhancing oxygen reduction reaction activity of Pt-shelled catalysts via subsurface alloying[期刊论文]，PHYSICAL CHEMISTRY CHEMICAL PHYSICS，2014-01-01
  • 154. DOI Tan, Huaqiao;Zhao, Zhao;Niu, Mang;Mao, Chengyu;Cao, Dapeng;Cheng, Daojian;Feng, Pingyun;Sun, Zaicheng
    A facile and versatile method for preparation of colored TiO2 with enhanced solar-driven photocatalytic activity[期刊论文]，NANOSCALE，2014-01-01
  • 155. DOI Li, Mingjiang;Li, Shaojie;Cheng, Daojian
    Influence of adsorbates on the segregation properties of Au-Pd bimetallic clusters[期刊论文]，COMPUTATIONAL MATERIALS SCIENCE，2014-01-01
  • 156. DOI Li, Mingjiang;Cheng, Daojian
    Molecular Dynamics Simulation of the Melting Behavior of Crown-Jewel Structured Au-Pd Nanoalloys[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-09-12
  • 157. DOI Cheng, Daojian;Yuan, Shuai;Ferrando, Riccardo
    Structure, chemical ordering and thermal stability of Pt-Ni alloy nanoclusters[期刊论文]，JOURNAL OF PHYSICS-CONDENSED MATTER，2013-09-04
  • 158. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Understanding Photoelectrochennical Properties of B-N Codoped Anatase TiO2 for Solar Energy Conversion[期刊论文]，JOURNAL OF PHYSICAL CHEMISTRY C，2013-08-08
  • 159. DOI Cheng, Daojian;Negreiros, Fabio R.;Apra, Edoardo;Fortunelli, Alessandro
    Computational Approaches to the Chemical Conversion of Carbon Dioxide[期刊论文]，CHEMSUSCHEM，2013-06-01
  • 160. DOI Fang, Yu;Cheng, Daojian;Niu, Mang;Yi, Yongjun;Wu, Wei
    Tailoring the electronic and optical properties of rutile TiO2 by (Nb + Sb, C) codoping from DFT plus U calculations[期刊论文]，CHEMICAL PHYSICS LETTERS，2013-04-19
  • 161. DOI Cheng, Daojian;Cao, Dapeng;Wang, Wenchuan
    Hydrogen storage in porous materials and nanoalloys as catalysts for fuel cell application by using multiscale simulation and experimental methods[会议论文]，ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY，2013-04-07
  • 162. DOI Cheng, Daojian;Jiang, Kun
    Structural stability and kinetics of small carbon clusters on a bimetallic Cu/Ni(111) surface: A first-principles study[期刊论文]，SURFACE SCIENCE，2013-03-01
  • 163. DOI Niu, Mang;Cheng, Daojian;Cao, Dapeng
    Enhanced photoelectrochemical performance of anatase TiO2 by metal-assisted S-O coupling for water splitting[期刊论文]，INTERNATIONAL JOURNAL OF HYDROGEN ENERGY，2013-02-06

软件著作

专利

  • 1. N掺杂多孔碳材料负载的双金属催化剂的制备方法及应用 ，CN114602497A
  • 2. 一种过渡金属钼改性的钯银-氧化铝催化剂及其制备方法与应用 ，CN114345336B
  • 3. 一种从废环氧乙烷催化剂中回收银和铼的方法 ，CN113564367A
  • 4. 一种用于二氧化碳电还原的单原子合金纳米线催化剂及其制备方法 ，CN113279013A
  • 5. 一种金属原子级分散催化剂的制备方法 ，CN113181941A
  • 6. 一种负载型PdAgCu三金属纳米催化剂的制备方法及应用 ，CN113181930A
  • 7. 一种改性TS-1分子筛复合催化剂及其制备方法和应用 ，CN113058643A
  • 8. 一种负载型PdW双金属单质纳米颗粒的制备方法 ，CN112676571A
  • 9. 一种可磁分离的烷烃氧化催化剂-载体体系制备方法 ，CN112058284A
  • 10. 一种金属纳米团簇结构优化方法 ，CN111326217A
  • 11. 一种催化材料高通量计算方法和系统 ，CN111177915A
  • 12. 基于高通量实验与计算的催化材料筛选方法和系统 ，CN111128311A
  • 13. 一种高通量催化剂性能分析装置和方法 ，CN111089936A
  • 14. 一种负载型银基多组分纳米催化剂的制备方法 ，CN111068714A
  • 15. 用于乙烯环氧化的负载型银基多组分纳米催化剂的制备方法 ，CN111068678A
  • 16. 导电载体自支撑花朵状Co3V2O8锂离子电池负极材料及制备 ，CN110120520A
  • 17. 一种对硝基苯酚加氢用铜锰双金属催化剂的制备方法 ，CN109876821A
  • 18. 一种铜纳米线负载银纳米颗粒的零维一维复合材料的制备方法 ，CN106825604A
  • 19. 一种亚纳米Pt选择性加氢催化剂、制备方法及其应用 ，CN 114471540 A
  • 20. 一种核壳式磁性钛硅分子筛催化剂的制备方法及其产品和应用 ，CN 114272955 B
  • 21. 一种PdNi合金催化剂的制备方法、产品及应用 ，CN 114225945 A
  • 22. 一种ZIF-8/钠基膨润土复合材料的制备方法及产品和应用 ，CN 113559825 A
  • 23. 一种异质结丰富的CoNiP-P纳米催化剂的制备方法及其应用 ，CN 113201752 A
  • 24. 一种氢氧直接合成过氧化氢的催化剂在线评价装置 ，202120075813.2
  • 25. 一种金属纳米团簇结构优化方法
  • 26. 一种核壳铜纳米线-有机金属骨架复合催化剂及其制备方法和应用
  • 27. 一种催化材料的高通量实验配液系统和方法
  • 28. 一种用于甲酸产氢的合金催化剂的制备方法及其应用
  • 29. 一种油相化学还原制备铜纳米线的方法
  • 30. 一种在电极上直接生长ZnO纳米线制备气敏元件的方法
  • 31. 一种形貌可控的铂铜纳米颗粒的制备方法
  • 32. 对硝基苯酚加氢负载型蛋黄-蛋壳纳米结构催化剂及制法
  • 33. 一种常温常压快速制备铜纳米线-金属有机骨架ZIF-8复合材料的方法
  • 34. 一种W改性载体负载金属Pd制备复合型催化剂的方法及其应用
  • 35. 一种Ag基纳米催化剂的制备方法
  • 36. Co 掺杂ZnO 纳米花材料的制备方法及其应用
  • 37. 一种简易制备单分散铂铜双金属纳米颗粒的方法

荣誉及奖励

  • 1. 难降解有机污染物催化氧化技术创新与应用 ，社会科技奖励 ，二等奖
  • 2. 活性组分定向构建的难降解有机污染物催化氧化技术 ，2020-12-24 00:00:00 ，社会科技奖励 ，二等奖
  • 3. 基于结构描述符的绿色化工催化剂设计与应用 ，2021-09-25 00:00:00 ，社会科技奖励 ，一等奖
  • 4. 低碳烃类催化转化催化剂的高通量筛选与应用 ，社会科技奖励 ，二等奖

招生信息

招生要求

勤奋，踏实，认真，负责，有团队精神
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