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Publication date Communities Collections Article title Author(s) Journal/Conference
12 May 2025 SERC Institute of High Performance Computing  Unveiling high-performance single-atom alloy catalysts for alkane dehydrogenation through DFT and machine learning synergy Haisong Feng, Zhen Ge, Yuan Deng, Pengxin Pu, Shiquan Zhao, Xin Song, Hao Yuan, Yaze Wu, Jing Yang, Yubing Si, Antonio Politano, Xin Zhang, Yong-Wei Zhang Journal of Catalysis
12 Mar 2025 SERC Institute of High Performance Computing  In Situ High Selectivity Contact-Electroreduction of CO2 to Methanol Using an Imine-Mediated Metal-Free Vitrimer Catalyst Nannan Wang, Haisong Feng, Jing Yang, Jie Zheng, Yong‐Wei Zhang, Nikos Hadjichristidis, Zibiao Li Angewandte Chemie International Edition
10 Dec 2024 SERC Institute of High Performance Computing  Designing and screening single‐atom alloy catalysts for CO2 reduction to CH3OH via DFT and machine learning Wenyu Zhou, Haisong Feng, Shihong Zhou, Mengxin Wang, Yuping Chen, Chenyang Lu, Hao Yuan, Jing Yang, Qun Li, Luxi Tan, Lichun Dong, Yong‐Wei Zhang AIChE Journal
13 Feb 2024 SERC Institute of High Performance Computing  Ultrathin LayCoOx Nanosheets with High Porosity Featuring Boosted Catalytic Oxidation of Benzene: Mechanism Elucidation via an Experiment–Theory Combined Paradigm Qun Li, Chunyan Deng, Wenyu Zhou, Peng Huang, Chenyang Lu, Haisong Feng, Lichun Dong, Luxi Tan, Yong-Wei Zhang, Cailong Zhou, Yi Qin, Dong Xia Inorganic Chemistry
24 Nov 2023 SERC Institute of High Performance Computing  Designing Efficient Single-Atom Alloy Catalysts for Selective C═O Hydrogenation: A First-Principles, Active Learning and Microkinetic Study Haisong Feng, Meng Zhang, Zhen Ge, Yuan Deng, Pengxin Pu, Wenyu Zhou, Hao Yuan, Jing Yang, Feng Li, Xin Zhang, Yong-Wei Zhang ACS Applied Materials & Interfaces
24 Nov 2023 SERC Institute of High Performance Computing  Designing Efficient Single-Atom Alloy Catalysts for Selective C═O Hydrogenation: A First-Principles, Active Learning and Microkinetic Study Haisong Feng, Meng Zhang, Zhen Ge, Yuan Deng, Pengxin Pu, Wenyu Zhou, Hao Yuan, Jing Yang, Feng Li, Xin Zhang, Yong-Wei Zhang ACS Applied Materials & Interfaces