Yang Qingyuan

1.      M. Qi, L. Cheng, H.-G. Wang,^* F. Cui, Q. Yang* and L. Chen, A Rhombic 2D Conjugated Metal–Organic Framework as Cathode for High-Performance Sodium-Ion Battery. Adv. Mater.2024, 36, 2401878.

2.      G. Xie, X. Bai, F. Yu, Q. Yang*, Z. Wang*, Oxygen vacancy engineering in MOF-derived AuCu/ZnO bimetallic catalysts for methanol synthesis via CO₂ hydrogenation. Catal. Today, 2024, 434, 114702.

3.      G. Xie, X. Bai, Y. Man, P. Ren, R. Jin, R. Zhang, K. K. Ostrikov, Z. Wang and. Q. Yang*, High-performance Al-doped Cu/ZnO catalysts for CO₂ hydrogenation to methanol: MIL-53(Al) source-enabled oxygen vacancy engineering and related promoting mechanisms. Chem. Eng. J., 2024, 480: 148195.

4.      J. Ren, W. Zeng, Y. Ying*, D. Liu and Q. Yang*, Discovery of anion-pillared metal–organic frameworks for efficient SO₂/CO₂ separation via computational screening, AIChE J., 2024, 70, e18351.

5.      Y.  Li, Y. Situ, K. Guan, Y. Guan, X. Huang, C. Cai, S. Li, Z. Liu, H. Liang, Y. Wu*, Q. Yang*, Z. Qiao*. High dynamic separation performance of metal–organic frameworks for D₂/H₂: Independent or competitive adsorption? AIChE J., 2024, 70, e18283.

6.      Y. Chen, Y. Ying*, Y. Situ, W. Li, J. Ren, T. Yan and Q. Yang*, Machine learning aided computational exploration of metal-organic frameworks with open Cu sites for the effective separation of hydrogen isotopes. Sep. Purif. Technol., 2024, 334, 126001.

7.      W. Li, Y. Situ, L. Ding,* Y. Chen and Q. Yang*, MOF-GRU: A MOFid-Aided Deep Learning Model for Predicting the Gas Separation Performance of Metal-Organic Frameworks. ACS Appl. Mater. Interfaces, 2023,15, 59887-59894.

8.       T. Yan, M. Tong*, D. Liu*,Q. Yang* and C. Zhong, Machine learning-assisted computational exploration of the optimal loading of IL in IL/COF composites for carbon dioxide capture. J. Mater. Chem. A2023, 11, 14911-14920.

9.      Z. Zhang, Q. Liu, D. Pan, Y. Xue, X. Liu, J. Zhao, Y. Ouyang, X. Ding, S. Xiao* and Q. Yang*, Formation of a PVP-protected C/UO₂/Pt catalyst in a direct ethanol fuel cell. RSC Adv., 2023, 13, 15910-15917.

10.   X. Chen, G. Li, S. Xiao*, W. Xue, X. Zhao* and Q. Yang*, Efficient Capture of Th(IV) and U(VI) by Radiation-Resistant Oxygen-Rich Ion Traps Based on Metal-Organic Framework. ACS Appl. Mater. Interfaces, 2023, 15, 25029-25040.

11.   C. Chen, Q. Mo, J. Fu, Q. Yang,* L. Zhang,* and C.-Y. Su, PtCu@Ir-PCN-222: Synergistic Catalysis of Bimetallic PtCu Nanowires in Hydrosilane-Concentrated Interspaces of an Iridium(III)−Porphyrin-Based Metal−Organic Framework. ACS Catal.2022, 12, 3604−3614.

12.   T. Yan, Z. Bi, D. Liu, X. Zhang, G. Lu,* and Q. Yang*, A Self-Evolutionary Methodology for Reverse Design of Novel MOFs. J. Phys. Chem. A, 2022, 126, 8476-8486.

13.   X. Chen, X. Liu, S. Xiao*, W. Xue, X. Zhao,* and Q. Yang*, A β-ray irradiation resistant MOF-based trap for efficient capture of Th(IV) ion. Sep. Purif. Technol., 2022, 297, 121517.

14.   J. Ren, W. Zeng, Y. Chen, X. Fu,* and Q. Yang*, In Silico Screening and Experimental Study of Anion-Pillared Metal-Organic Frameworks for Hydrogen Isotope Separation. Sep. Purif. Technol., 2022, 295, 121286.

15.   Y. Chen, X. Bai, D. Liu, X. Fu and Q. Yang*, High-Throughput Computational Exploration of MOFs with Open-Cu-Sites for Adsorptive Separation of Hydrogen Isotopes. ACS Appl. Mater. Interfaces, 2022, 14, 24980−24991.

16.   P. Yang, G. Lu*, Q. Yang*, L. Liu, X. Lai, D. Yu, Analyzing acetylene Adsorption of Metal-Organic Frameworks Based on Machine Learning. Green Energy. Environ., 2022, 7, 1062-1070.

17.   J. Ren, M. Chang, W. Zeng, Y. Xia, D. Liu,* G. Maurin* and Q. Yang*, Computer-Aided Discovery of MOFs with Calixarene-Analogous Microenvironment for Exceptional SF₆ Capture. Chem. Mater., 2021, 33, 5108-5114.

18.   C. Liu, Y. Liu, Z. Xiang*, D. Liu* and Q. Yang*, Bimetallic MOF-derived sulfides with heterojunction interfaces synthesized for photocatalytic hydrogen evolution. Ind. Eng. Chem. Res., 2021, 60, 11439-11449.

19.   S.-M. Wang, F. Wang, Y. Dong, M. Shivanna, Q. Dong, X.-T. Mu, J. Duan, Q. Yang*, M. J. Zaworotko, Q.-Y. Yang*, Reversed C₂H₆/C₂H₄ separation in interpenetrated diamondoid coordination networks with enhanced host–guest interaction. Sep. Purif. Technol., 2021, 276, 119385.

20.   M. Chang, J. Ren, Y. Wei, J.-X. Wang,* Q. Yang*, D. Liu,* J.-F. Chen, A robust metal-organic framework with guest molecules induced splint-like pore confinement to construct propane-trap for propylene purification. Sep. Purif. Technol., 2021, 279, 119656.

21.   T. Zhou, L. Wang, X. Huang, J. Unruangsri, H. Zhang, R. Wang, Q. Song, Q. Yang, W. Li, C. Wang, K. Takahashi, H. Xu and J. Guo, PEG-stabilized coaxial stacking of two-dimensional covalent organic frameworks for enhanced photocatalytic hydrogen evolution. Nat. Commun., 2021, 12, 3934.

22.   Y. Wang, G. Wang, Y. Liu, B. Zheng*, Z. Wang* and Q. Yang*, Identifying Promising Covalent-Organic Frameworks for Decarburization and Desulfurization from Biogas via Computational Screening. ACS Sustainable Chem. Eng., 2021, 9, 8858-8867.

23.   L. Wang, W. Sun* and Q. Yang*, Exploration of the Influences of the PODE₃ Additive on the Initial Pyrolysis of Diesel by ReaxFF Molecular Dynamics Simulations. Energy Fuel, 2021, 35, 9825-9835.

24.   M. Chang, J. Ren, Q. Yang* and D. Liu*, A robust calcium-based microporous metal-organic framework for efficient CH₄/N₂ separation, Chem. Eng. J., 2021, 408, 127294.

25.   J. Liao, W. Zeng, B. Zheng, X. Cao, Z. Wang*, G. Wang and Q. Yang*, Highly efficient CO₂ capture and conversion of a microporous acylamide functionalized rht-type metal–organic framework, Inorg. Chem. Front., 2020, 7, 1939-1948.

26.   D. Cao, J. Ren, Y. Gong, H. Huang, X. Fu, M. Chang, X. Chen, C. Xiao, D. Liu, Q. Yang*, C. Zhong, S. Peng* and Z. Zhang*, Quantum Sieving of H₂/D₂ in MOFs: A study on the correlation between the separation performance, pore size and temperature, J. Mater. Chem. A, 2020, 8, 6319-6327.

27.   L. Liu, L. Wang, D. Liu, Q. Yang* and C. Zhong*, High-Throughput computational screening of Cu-MOFs with open metal site for efficient C₂H₂/C₂H₄ separation, Green Energy. Environ., 2020, 5, 333-340.

28.   Y. Lan, X. Han, M. Tong, H. Huang, Q. Yang*, D. Liu, X. Zhao* and C. Zhong*, Materials genomics methods for high-throughput construction of COFs and targeted synthesis. Nature Commun., 2018, 9, 5274(1-10)

29.   C. Zhang, L. Wang, G. Maurin and Q. Yang*. In Silico Screening of MOFs with Open Copper Sites for C₂H₂/CO₂ Separation. AIChE J., 2018, 64, 4089-4096.

30.   C. Zhang, Y. Lan, X. Guo, Q. Yang* and C. Zhong. Materials Genomics-Guided Ab Initio Screening of MOFs with Open Copper Sites for Acetylene Storage. AIChE J., 2018, 64, 1389-1398.

31.   M. Tong, Y. Lan, Q. Yang* and C. Zhong. High-throughput computational screening and design of nanoporous materials for methane storage and carbon dioxide capture. Green Energy Environ.2018, 3, 107-119.

32.   X. Guo, D. Liu, T. Han, H. Huang, Q. Yang^*, C. Zhong. Preparation of thin film nanocomposite membranes with surface modified MOF for high flux organic solvent nanofiltration. AIChE J., 2017, 63, 1303-1312.

33.   M. Tong*, Y. Lan, Q. Yang* and C. Zhong. Exploring the structure-property relationships of covalent organic frameworks for noble gas separations. Chem. Eng. Sci.2017, 168, 456-464.

34.   S. Li, K. Wang, Y. Shi, Y. Cui, B. Chen, B. He, W. Dai, H. Zhang, X. Wang, C. Zhong, H. Wu, Q. Yang* and Q. Zhang*. Novel biological functions of ZIF-NP as a delivery vehicle: high pulmonary accumulation, favorable biocompatibility, and improved therapeutic outcome. Adv. Funct. Mater.2016, 26, 2715-2727.

35.   M. Tong, Q. Yang*, Q. Ma, D. Liu and C. Zhong*, Few-Layered Ultrathin Covalent Organic Framework Membranes for Gas Separation: A Computational Study. J. Mater. Chem. A, 2016, 4, 124 –131.

36.   W. Xue, Z. Li, H. Huang, Q. Yang,* D. Liu, Qing Xu*, Effects of Ionic Liquid Dispersion in Metal-Organic Frameworks and Covalent Organic Frameworks on CO₂ Capture: A Computational Study. Chem. Eng. Sci., 2016, 140, 1-9.

37.   Y. Ban, Z. Li, Y. Li,* Y. Peng, H. Jin, W. Jiao, A. Guo, P. Wang, Q. Yang,* C. Zhong, and W. Yang*. Confinement of Ionic Liquids in Nanocages: Tailoring Molecular Sieving Property of ZIF-8 for Membrane-Based CO₂ Capture. Angew. Chem. Int. Ed., 2015,54, 15483–15487.

38.   X. Guo, H. Huang, Y. Ban, Q. Yang,* Y. Xiao, Y. Li,* W. Yang and C. Zhong. Mixed matrix membranes incorporated with amine-functionalized titanium-based metal-organic framework for CO₂/CH₄ separation. J. Membr. Sci., 2015, 478, 130−139.

39.   Q. Yang, D. Liu, C. Zhong* and J. Li. Development of computational methodologies for metal-organic frameworks and their application in gas separations, Chem. Rev.2013, 113, 8261–8323.

40.   Q. Yang, S. Vaesen, F. Ragon, A. D. Wiersum, D. Wu, A. Lago, T. Devic, C. Martineau, F. Taulelle, P. L. Llewellyn, C. Serre*, H. Jobic, C. Zhong, G. De Weireld* and G. Maurin*. A water stable metal–organic framework with optimal features for CO₂ capture, Angew. Chem. Int. Ed., 2013, 52, 10316–10320.