基本信息
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职业迁徙
个人简介
Research Interests:
The research in our group bridges the gap between applied electronic structure theory and first-principles molecular simulation to enable predictive computational discovery of new materials and new chemistry. This research relies heavily on sophisticated high-performance and high-throughput computing paradigms, employing modern graphics processing unit (GPU) based computing. A primary focus is electrochemistry and electrochemical energy storage applications, and we seek to develop a fundamental understanding of how redox chemistry and other chemical and physical processes are modulated by strong electric fields. We are interested in chemical reaction mechanisms within highly ionic and heterogeneous environments, and are developing multi-scale modeling approaches to study chemical reactivity in the condensed phase.
研究兴趣
论文共 82 篇作者统计合作学者相似作者
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期刊级别
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The Journal of chemical physicsno. 20 (2024)
JOURNAL OF CHEMICAL PHYSICSno. 3 (2024)
The journal of physical chemistry. Bno. 23 (2023): 5317-5333
arXiv (Cornell University) (2023)
JOURNAL OF PHYSICAL CHEMISTRY Cno. 39 (2023): 19489-19508
ECS Meeting Abstractsno. 55 (2022): 2098-2098
Journal of Chemical Physicsno. 2 (2022): 029901-029901
JOURNAL OF PHYSICAL CHEMISTRY Cno. 13 (2022): 5822-5837
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作者统计
#Papers: 82
#Citation: 1376
H-Index: 23
G-Index: 36
Sociability: 4
Diversity: 2
Activity: 32
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