孙耿 - 重庆大学 - 化学化工学院

个人简介

2022至今重庆大学化学化工学院副教授 2016-2021 加州大学洛杉矶分校博士后（合作导师: Prof. Philippe Sautet) 2011-2016 北京大学化学与分子工程学院物理化学博士（导师：蒋鸿教授） 2007-2011 北京大学化学与分子工程学院化学学士

研究领域

1. 采用密度泛函方法研究固体-气体、固体-液体界面的原子、电子结构和化学反应机理 2. 程序算法开发用于自动化结构和反应机理研究 3. 机器学习方法在材料和化学反应中的应用

近期论文

查看导师新发文章（温馨提示：请注意重名现象，建议点开原文通过作者单位确认）

Geng Sun, Philippe Sautet, Active Site Fluxional Restructuring as a New Paradigm in Triggering Reaction Activity for Nanocluster Catalysis,Acc. Chem. Res. 2021, 54, 3841-3849 Fang Liu#, Geng Sun#, Hao Bin Wu, Gen Chen, Duo Xu, Runwei Mo, Li Shen, Xianyang Li, Shengxiang Ma, Ran Tao, Xinru Li, Xinyi Tan, Bin Xu, Ge Wang, Bruce S. Dunn, Philippe Sautet & Yunfeng Lu, Dual redox mediators accelerate the electrochemical kinetics of lithium-sulfur batteries, Nat. Commun. 2020, 11, 5215 Bing Zhang#, Geng Sun#, Shipeng Ding#, Hiroyuki Asakura, Jia Zhang, Philippe Sautet, Ning Yan, Atomically Dispersed Pt1–Polyoxometalate Catalysts: How Does Metal–Support Interaction Affect Stability and Hydrogenation Activity? J. Am. Chem. Soc. 2019, 141, 20, 8185–8197 Geng Sun, Philippe Sautet, Metastable Structures in Cluster Catalysis from First-Principles: Structural Ensemble in Reaction Conditions and Metastability Triggered Reactivity, J. Am. Chem. Soc. 2018, 140, 8, 2812–2820 Geng Sun, Jack T. Fuller III, Anastassia N. Alexandrova, Philippe Sautet, Global Activity Search Uncovers Reaction Induced Concomitant Catalyst Restructuring for Alkane Dissociation on Model Pt Catalysts,ACS Catal. 2021, 11, 1877-1885 Geng Sun, Anastassia N Alexandrova, Philippe Sautet, Structural Rearrangements of Subnanometer Cu Oxide Clusters Govern Catalytic Oxidation,ACS Catal. 2020, 10, 9, 5309–5317 Geng Sun, Philippe Sautet, Toward Fast and Reliable Potential Energy Surfaces for Metallic Pt Clusters by Hierarchical Delta Neural Networks,J. Chem. Theory Comput. 2019, 15, 10, 5614–5627 Geng Sun, Anastassia N Alexandrova, Philippe Sautet, Pt8 cluster on alumina under a pressure of hydrogen: Support-dependent reconstruction from first-principles global optimization,J Chem. Phys. 2019, 151, 194703 Geng Sun, Hong Jiang, Ab initio molecular dynamics with enhanced sampling for surface reaction kinetics at finite temperatures: CH2=CH + H on Ni(111) as a case study, J. Chem. Phys., 2015, 143, 23, 234706