- [JCTC] Prof. Binju Wang published a paper entitled "Matching the Probability Distribution On-the-Fly: OPES-Based Dual-Level Free Energy Calculation" 2025-09-01
- [Nature Communications] Prof. Gang Fu published a paper entitled "Internally hollow Cu2O nanoframes with the abundance of {110} facets enhance direct propyle... 2025-09-01
- [EES] Profs. Nanfeng Zheng and Binghui Wu published a paper entitled "Ligand engineering of solution-processed NiOx for high-performance n–i–p perovskite p... 2025-06-05
- [ACIE] Prof. Yuan-Zhi Tan published a paper entitled "Phenylene Cage Synthesized by Metal-Mediated Assembly of Phenylene Macrocycle and Its Piezofluorochromi... 2025-06-05
- [ACIE] Prof. Jian-Feng Li published a paper entitled "Lewis-Base Electrolyte Additive Mediates Interfacial Chemistry for Stable Lithium Metal Batteries" 2025-06-05
- [ACIE] Profs. Zhong Chen and Shi-Gang Sun published a paper entitled "Operando Magnetic Resonance Imaging for Visualizing Electrochemical Triple-Phase Bounda... 2025-06-05
- [JACS] Prof. Jian-Feng Li published a paper entitled "Unveiling the Solvation Chemistry and Surface Effects on CO2 Reduction Reaction Pathways in Nonaqueous ... 2025-06-05
- [Nature Communications] Prof. Haohua Huo published a paper entitled "Illuminating enantioselective alkyl−alkyl coupling" 2025-05-12
- [ACIE] Prof. Cheng Wang published a paper entitled "Machine Learning Reveals In-Cavity vs Surface Activity for Selective C–H Borylation by Metal-Organic Fra... 2025-05-12
- [Energy Environ. Sci.] Profs. Haifeng Xiong and Xiaoqing Huang published a paper entitled "Single-atom mediated crystal facet engineering for the exceptional... 2025-05-12
Title: Matching the Probability Distribution On-the-Fly: OPES-Based Dual-Level Free Energy CalculationAuthors: Shuming Cheng, Shengheng Yan and Binju Wang*Abstract: The free energy profile (FE Profile) is essential for understanding chemical processes in complex systems. However, achieving sufficient sampling with an accurate potential in the FE profile calculations for chemical reactions in complex ...
Title: Internally hollow Cu2O nanoframes with the abundance of {110} facets enhance direct propylene epoxidationAuthors: Yueming Qiu, Yichen Zhang, Ronghui Zhang, Meng Huang, Kok Bing Tan, Guowu Zhan, Gang Fu*, Qingbiao Li* & Jiale Huang*Abstract: The gas-phase direct epoxidation of propylene (DEP) using molecular oxygen, which has been deemed the ‘dream reaction’ for propylene oxide (PO) production ...
Title: Ligand engineering of solution-processed NiOx for high-performance n–i–p perovskite photovoltaicsAuthors: Fang Cao, Xinfeng Dai, Di Tian, Yingchen Peng, Jun Yin, Jing Li*, Ye Yang, Nanfeng Zheng* and Binghui Wu*Abstract: In n–i–p halide perovskite solar cells (PSCs), replacing organic p-type semiconductors with inorganic alternatives holds significant potential for enhancing long-term stability....
Title: Phenylene Cage Synthesized by Metal-Mediated Assembly of Phenylene Macrocycle and Its Piezofluorochromic BehaviorAuthors: Qing-Song Deng, Xuan-Wen Chen, Xi-Han Yu, Jiang-Feng Xing, Bing-Hui Zheng, Guanjun Xiao*, Bo Zou, Yuan-Zhi Tan*Abstract: A phenylene macrocycle containing two meta-phenylene units positioned opposite each other was used as a building block to construct phenylene cages via ...
Title: Lewis-Base Electrolyte Additive Mediates Interfacial Chemistry for Stable Lithium Metal BatteriesAuthors: Rong Fang, Dr. Siyuan Ma, Lian Ding, Dr. Yu Gu*, Xin Dong, Dr. Duan-Hui Si, Prof. Jing-Hua Tian*, Dr. Xiu-Mei Lin*, Prof. Bing-Wei Mao, Prof. Jian-Feng Li*Abstract: Electrolytes play a crucial role in regulating interfacial chemistry, which is essential for the development of high-energy-...
Title: Operando Magnetic Resonance Imaging for Visualizing Electrochemical Triple-Phase BoundaryAuthors: Wen-Long Jiang, Shuo-Hui Cao*, Chun-Yu Qiu, Prof. Hui-Jun Sun, Li-Na Wang, Jun-Bo Sheng, Dr. Li-Fei Ji, Shuo Liu, Prof. Zu-Rong Ni, Prof. Shu-Hu Yin, Prof. Xiao-Ping Zhang, Prof. Yan-Xia Jiang, Prof. Yu-Cheng Wang, Prof. Zhi-You Zhou, Zhong Chen*, Shi-Gang Sun*Abstract: The triple-phase boundary ...
Title: Unveiling the Solvation Chemistry and Surface Effects on CO2 Reduction Reaction Pathways in Nonaqueous Li–CO2 BatteriesAuthors: Fan Gao, Mu-Fei Yue, Daniel Wun Fung Cheung, Weimin Yang, Zhi-Feng He, Yu Gu*, Shisheng Zheng*, Xiaobin Zhong, Siyuan Ma, Wei-Ping Chen, Jing-Hua Tian, Jin-Chao Dong*, Jian-Feng Li*Abstract: Achieving highly reversible Li–CO2 batteries requires efficient and reversible ...
Title: Illuminating enantioselective alkyl−alkyl couplingAuthors: Weisai Zu, Xinlong Luo & Haohua Huo*Abstract: The catalytic enantioselective formation of alkyl−alkyl bonds from simple feedstock chemicals remains a formidable challenge in organic synthesis. Now, an enantioconvergent approach that couples styrenyl aziridines with unactivated olefins using a chiral nickel catalyst and visible light ...
Title: Machine Learning Reveals In-Cavity vs Surface Activity for Selective C–H Borylation by Metal-Organic Framework CatalystsAuthors: Zhaomin Su, Bingling Dai, Xue Wang, Yibin Jiang, Wenbin Lin, Cheng Wang*Abstract: Metal-organic frameworks (MOFs) provide an expansive and tunable platform for heterogeneous catalysis, yet distinguishing between catalytic reactions occurring within their pores and ...
Title: Single-atom mediated crystal facet engineering for the exceptional production of acetate in CO electrolysisAuthors: Jiacheng Liu, Yan Wen, Wei Yan, Zhongliang Huang, Xiaozhi Liu, Xuan Huang, Changhong Zhan, Yuqi Zhang, Wei-Hsiang Huang, Chih-Wen Pao, Zhiwei Hu, Dong Su, Shunji Xie, Ye Wang, Jiajia Han*, Haifeng Xiong*, Xiaoqing Huang* and Nanjun Chen*Abstract: The production of value-added liquid ...