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程道建

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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
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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
工业催化原理 2025 32 专业必修
绿色化工大讲堂 2025 24 201 素质核心课程
工业催化原理 2024 32 55 专业必修
绿色化工大讲堂 2024 24 163 素质核心课程
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 素质教育课程选修
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 素质教育课程选修
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

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 2026 32
催化理论与计算 2026 32 C专业方向及特色课
催化理论与计算 2025 32 C专业方向及特色课
工业催化剂的研发、制备与应用 2025 32
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. 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
  • 7. 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
  • 8. 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
  • 9. 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
  • 10. 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
  • 11. 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
  • 12. 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
  • 13. 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
  • 14. 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
  • 15. 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
  • 16. 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. 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
  • 17. 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
  • 18. 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
  • 19. 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
  • 20. 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
  • 21. 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
  • 22. HPC业务Wep应用初步探索 ,项目时间:2013-12-04 至 2014-02-01
  • 23. 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 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
  • 2. 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
  • 3. 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
  • 4. 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
  • 5. 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
  • 6. 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
  • 7. 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
  • 8. 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
  • 9. 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
  • 10. 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
  • 11. 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
  • 12. 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
  • 13. 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
  • 14. 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
  • 15. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文],Advances in Physics-X,2021-01-01
  • 16. 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
  • 17. 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
  • 18. 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
  • 19. 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
  • 20. 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
  • 21. 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
  • 22. 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
  • 23. 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
  • 24. 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
  • 25. 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
  • 26. 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
  • 27. 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
  • 28. 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
  • 29. 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
  • 30. 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
  • 31. 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
  • 32. 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
  • 33. 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
  • 34. 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
  • 35. 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
  • 36. 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
  • 37. 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
  • 38. 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
  • 39. 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
  • 40. 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
  • 41. 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
  • 42. 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
  • 43. 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
  • 44. 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
  • 45. 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
  • 46. 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
  • 47. 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
  • 48. 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
  • 49. 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
  • 50. 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
  • 51. 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
  • 52. 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
  • 53. 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
  • 54. 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
  • 55. 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
  • 56. 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
  • 57. 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
  • 58. 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
  • 59. 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
  • 60. 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
  • 61. 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
  • 62. 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
  • 63. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文],MOLECULAR SIMULATION,2016-01-01
  • 64. 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
  • 65. 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
  • 66. 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
  • 67. 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
  • 68. 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
  • 69. 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
  • 70. 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
  • 71. 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
[+][-] 2030年
  • 1. 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
  • 2. 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
  • 3. 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
  • 4. 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
  • 5. 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
  • 6. 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
  • 7. 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
  • 8. 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
  • 9. 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
  • 10. 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
  • 11. 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
  • 12. 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
  • 13. 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
  • 14. 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
  • 15. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文],Advances in Physics-X,2021-01-01
  • 16. 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
  • 17. 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
  • 18. 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
  • 19. 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
  • 20. 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
  • 21. 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
  • 22. 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
  • 23. 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
  • 24. 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
  • 25. 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
  • 26. 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
  • 27. 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
  • 28. 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
  • 29. 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
  • 30. 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
  • 31. 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
  • 32. 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
  • 33. 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
  • 34. 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
  • 35. 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
  • 36. 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
  • 37. 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
  • 38. 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
  • 39. 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
  • 40. 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
  • 41. 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
  • 42. 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
  • 43. 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
  • 44. 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
  • 45. 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
  • 46. 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
  • 47. 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
  • 48. 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
  • 49. 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
  • 50. 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
  • 51. 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
  • 52. 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
  • 53. 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
  • 54. 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
  • 55. 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
  • 56. 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
  • 57. 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
  • 58. 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
  • 59. 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
  • 60. 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
  • 61. 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
  • 62. 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
  • 63. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文],MOLECULAR SIMULATION,2016-01-01
  • 64. 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
  • 65. 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
  • 66. 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
  • 67. 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
  • 68. 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
  • 69. 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
  • 70. 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
  • 71. 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
[+][-] 2029年
  • 1. 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
  • 2. 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
  • 3. 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
  • 4. 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
  • 5. 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
  • 6. 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
  • 7. 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
  • 8. 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
  • 9. 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
  • 10. 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
  • 11. 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
  • 12. 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
  • 13. 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
  • 14. 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
  • 15. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文],Advances in Physics-X,2021-01-01
  • 16. 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
  • 17. 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
  • 18. 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
  • 19. 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
  • 20. 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
  • 21. 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
  • 22. 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
  • 23. 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
  • 24. 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
  • 25. 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
  • 26. 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
  • 27. 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
  • 28. 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
  • 29. 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
  • 30. 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
  • 31. 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
  • 32. 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
  • 33. 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
  • 34. 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
  • 35. 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
  • 36. 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
  • 37. 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
  • 38. 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
  • 39. 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
  • 40. 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
  • 41. 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
  • 42. 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
  • 43. 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
  • 44. 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
  • 45. 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
  • 46. 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
  • 47. 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
  • 48. 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
  • 49. 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
  • 50. 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
  • 51. 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
  • 52. 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
  • 53. 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
  • 54. 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
  • 55. 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
  • 56. 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
  • 57. 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
  • 58. 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
  • 59. 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
  • 60. 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
  • 61. 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
  • 62. 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
  • 63. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文],MOLECULAR SIMULATION,2016-01-01
  • 64. 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
  • 65. 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
  • 66. 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
  • 67. 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
  • 68. 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
  • 69. 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
  • 70. 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
  • 71. 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
[+][-] 2028年
  • 1. 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
  • 2. 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
  • 3. 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
  • 4. 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
  • 5. 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
  • 6. 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
  • 7. 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
  • 8. 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
  • 9. 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
  • 10. 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
  • 11. 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
  • 12. 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
  • 13. 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
  • 14. 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
  • 15. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文],Advances in Physics-X,2021-01-01
  • 16. 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
  • 17. 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
  • 18. 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
  • 19. 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
  • 20. 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
  • 21. 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
  • 22. 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
  • 23. 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
  • 24. 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
  • 25. 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
  • 26. 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
  • 27. 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
  • 28. 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
  • 29. 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
  • 30. 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
  • 31. 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
  • 32. 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
  • 33. 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
  • 34. 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
  • 35. 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
  • 36. 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
  • 37. 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
  • 38. 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
  • 39. 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
  • 40. 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
  • 41. 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
  • 42. 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
  • 43. 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
  • 44. 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
  • 45. 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
  • 46. 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
  • 47. 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
  • 48. 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
  • 49. 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
  • 50. 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
  • 51. 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
  • 52. 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
  • 53. 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
  • 54. 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
  • 55. 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
  • 56. 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
  • 57. 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
  • 58. 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
  • 59. 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
  • 60. 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
  • 61. 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
  • 62. 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
  • 63. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文],MOLECULAR SIMULATION,2016-01-01
  • 64. 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
  • 65. 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
  • 66. 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
  • 67. 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
  • 68. 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
  • 69. 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
  • 70. 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
  • 71. 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
[+][-] 2027年
  • 1. 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
  • 2. 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
  • 3. 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
  • 4. 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
  • 5. 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
  • 6. 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
  • 7. 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
  • 8. 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
  • 9. 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
  • 10. 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
  • 11. 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
  • 12. 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
  • 13. 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
  • 14. 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
  • 15. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文],Advances in Physics-X,2021-01-01
  • 16. 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
  • 17. 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
  • 18. 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
  • 19. 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
  • 20. 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
  • 21. 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
  • 22. 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
  • 23. 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
  • 24. 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
  • 25. 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
  • 26. 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
  • 27. 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
  • 28. 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
  • 29. 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
  • 30. 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
  • 31. 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
  • 32. 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
  • 33. 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
  • 34. 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
  • 35. 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
  • 36. 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
  • 37. 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
  • 38. 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
  • 39. 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
  • 40. 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
  • 41. 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
  • 42. 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
  • 43. 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
  • 44. 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
  • 45. 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
  • 46. 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
  • 47. 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
  • 48. 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
  • 49. 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
  • 50. 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
  • 51. 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
  • 52. 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
  • 53. 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
  • 54. 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
  • 55. 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
  • 56. 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
  • 57. 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
  • 58. 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
  • 59. 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
  • 60. 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
  • 61. 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
  • 62. 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
  • 63. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文],MOLECULAR SIMULATION,2016-01-01
  • 64. 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
  • 65. 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
  • 66. 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
  • 67. 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
  • 68. 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
  • 69. 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
  • 70. 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
  • 71. 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
[+][-] 2026年
  • 1. 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
  • 2. 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
  • 3. 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
  • 4. 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
  • 5. 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
  • 6. 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
  • 7. 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
  • 8. 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
  • 9. 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
  • 10. 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
  • 11. 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
  • 12. 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
  • 13. 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
  • 14. 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
  • 15. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文],Advances in Physics-X,2021-01-01
  • 16. 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
  • 17. 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
  • 18. 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
  • 19. 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
  • 20. 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
  • 21. 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
  • 22. 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
  • 23. 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
  • 24. 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
  • 25. 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
  • 26. 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
  • 27. 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
  • 28. 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
  • 29. 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
  • 30. 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
  • 31. 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
  • 32. 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
  • 33. 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
  • 34. 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
  • 35. 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
  • 36. 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
  • 37. 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
  • 38. 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
  • 39. 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
  • 40. 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
  • 41. 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
  • 42. 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
  • 43. 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
  • 44. 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
  • 45. 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
  • 46. 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
  • 47. 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
  • 48. 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
  • 49. 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
  • 50. 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
  • 51. 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
  • 52. 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
  • 53. 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
  • 54. 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
  • 55. 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
  • 56. 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
  • 57. 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
  • 58. 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
  • 59. 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
  • 60. 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
  • 61. 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
  • 62. 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
  • 63. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文],MOLECULAR SIMULATION,2016-01-01
  • 64. 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
  • 65. 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
  • 66. 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
  • 67. 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
  • 68. 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
  • 69. 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
  • 70. 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
  • 71. 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
[+][-] 2025年
  • 1. 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
  • 2. 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
  • 3. 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
  • 4. 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
  • 5. 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
  • 6. 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
  • 7. 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
  • 8. 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
  • 9. 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
  • 10. 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
  • 11. 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
  • 12. 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
  • 13. 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
  • 14. 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
  • 15. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文],Advances in Physics-X,2021-01-01
  • 16. 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
  • 17. 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
  • 18. 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
  • 19. 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
  • 20. 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
  • 21. 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
  • 22. 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
  • 23. 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
  • 24. 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
  • 25. 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
  • 26. 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
  • 27. 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
  • 28. 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
  • 29. 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
  • 30. 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
  • 31. 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
  • 32. 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
  • 33. 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
  • 34. 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
  • 35. 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
  • 36. 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
  • 37. 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
  • 38. 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
  • 39. 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
  • 40. 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
  • 41. 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
  • 42. 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
  • 43. 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
  • 44. 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
  • 45. 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
  • 46. 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
  • 47. 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
  • 48. 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
  • 49. 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
  • 50. 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
  • 51. 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
  • 52. 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
  • 53. 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
  • 54. 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
  • 55. 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
  • 56. 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
  • 57. 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
  • 58. 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
  • 59. 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
  • 60. 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
  • 61. 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
  • 62. 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
  • 63. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文],MOLECULAR SIMULATION,2016-01-01
  • 64. 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
  • 65. 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
  • 66. 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
  • 67. 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
  • 68. 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
  • 69. 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
  • 70. 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
  • 71. 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
[+][-] 2024年
  • 1. 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
  • 2. 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
  • 3. 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
  • 4. 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
  • 5. 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
  • 6. 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
  • 7. 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
  • 8. 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
  • 9. 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
  • 10. 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
  • 11. 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
  • 12. 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
  • 13. 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
  • 14. 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
  • 15. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文],Advances in Physics-X,2021-01-01
  • 16. 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
  • 17. 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
  • 18. 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
  • 19. 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
  • 20. 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
  • 21. 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
  • 22. 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
  • 23. 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
  • 24. 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
  • 25. 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
  • 26. 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
  • 27. 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
  • 28. 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
  • 29. 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
  • 30. 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
  • 31. 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
  • 32. 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
  • 33. 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
  • 34. 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
  • 35. 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
  • 36. 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
  • 37. 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
  • 38. 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
  • 39. 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
  • 40. 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
  • 41. 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
  • 42. 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
  • 43. 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
  • 44. 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
  • 45. 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
  • 46. 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
  • 47. 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
  • 48. 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
  • 49. 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
  • 50. 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
  • 51. 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
  • 52. 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
  • 53. 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
  • 54. 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
  • 55. 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
  • 56. 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
  • 57. 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
  • 58. 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
  • 59. 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
  • 60. 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
  • 61. 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
  • 62. 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
  • 63. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文],MOLECULAR SIMULATION,2016-01-01
  • 64. 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
  • 65. 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
  • 66. 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
  • 67. 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
  • 68. 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
  • 69. 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
  • 70. 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
  • 71. 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
[+][-] 2023年
  • 1. 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
  • 2. 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
  • 3. 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
  • 4. 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
  • 5. 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
  • 6. 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
  • 7. 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
  • 8. 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
  • 9. 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
  • 10. 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
  • 11. 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
  • 12. 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
  • 13. 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
  • 14. 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
  • 15. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文],Advances in Physics-X,2021-01-01
  • 16. 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
  • 17. 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
  • 18. 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
  • 19. 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
  • 20. 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
  • 21. 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
  • 22. 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
  • 23. 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
  • 24. 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
  • 25. 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
  • 26. 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
  • 27. 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
  • 28. 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
  • 29. 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
  • 30. 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
  • 31. 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
  • 32. 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
  • 33. 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
  • 34. 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
  • 35. 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
  • 36. 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
  • 37. 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
  • 38. 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
  • 39. 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
  • 40. 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
  • 41. 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
  • 42. 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
  • 43. 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
  • 44. 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
  • 45. 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
  • 46. 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
  • 47. 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
  • 48. 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
  • 49. 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
  • 50. 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
  • 51. 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
  • 52. 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
  • 53. 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
  • 54. 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
  • 55. 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
  • 56. 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
  • 57. 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
  • 58. 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
  • 59. 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
  • 60. 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
  • 61. 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
  • 62. 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
  • 63. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文],MOLECULAR SIMULATION,2016-01-01
  • 64. 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
  • 65. 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
  • 66. 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
  • 67. 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
  • 68. 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
  • 69. 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
  • 70. 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
  • 71. 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
[+][-]2023年之前
  • 1. 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
  • 2. 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
  • 3. 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
  • 4. 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
  • 5. 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
  • 6. 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
  • 7. 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
  • 8. 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
  • 9. 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
  • 10. 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
  • 11. 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
  • 12. 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
  • 13. 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
  • 14. 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
  • 15. DOI Yu, Zuran;Xu, Haoxiang;Cheng, Daojian
    Design of Single Atom Catalysts[期刊论文],Advances in Physics-X,2021-01-01
  • 16. 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
  • 17. 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
  • 18. 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
  • 19. 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
  • 20. 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
  • 21. 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
  • 22. 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
  • 23. 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
  • 24. 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
  • 25. 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
  • 26. 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
  • 27. 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
  • 28. 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
  • 29. 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
  • 30. 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
  • 31. 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
  • 32. 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
  • 33. 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
  • 34. 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
  • 35. 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
  • 36. 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
  • 37. 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
  • 38. 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
  • 39. 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
  • 40. 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
  • 41. 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
  • 42. 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
  • 43. 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
  • 44. 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
  • 45. 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
  • 46. 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
  • 47. 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
  • 48. 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
  • 49. 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
  • 50. 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
  • 51. 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
  • 52. 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
  • 53. 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
  • 54. 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
  • 55. 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
  • 56. 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
  • 57. 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
  • 58. 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
  • 59. 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
  • 60. 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
  • 61. 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
  • 62. 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
  • 63. DOI Cheng, Daojian
    Frontiers of Molecular Simulation in China[期刊论文],MOLECULAR SIMULATION,2016-01-01
  • 64. 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
  • 65. 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
  • 66. 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
  • 67. 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
  • 68. 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
  • 69. 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
  • 70. 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
  • 71. 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

软件著作

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  • 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
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  • 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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