100 citations
Counting papers with at most 25 authors, so collaboration author lists do not stand in for the people here.
- Chinese Academy of SciencesCN4 papers
- Peking UniversityCN4 papers
- Art Institute of PortlandUS3 papers
- Institute of Applied Physics and Computational MathematicsCN3 papers
- Collaborative Innovation Center of Chemistry for Energy MaterialsCN2 papers
- Princeton UniversityUS2 papers
- Tsinghua UniversityCN2 papers
- University of Chinese Academy of SciencesCN2 papers
- University of Science and Technology of ChinaCN2 papers
- Xiamen UniversityCN2 papers
- Asahi Kasei (Japan)JP1 paper
- Baidu (China)CN1 paper
Showing 2024Show all
2 papers · 1 filter
physics.chem-ph2024★ 33 cited
On the design space between molecular mechanics and machine learning force fields
Yuanqing Wang, Kenichiro Takaba, Michael S. Chen +14
A force field as accurate as quantum mechanics (QM) and as fast as molecular mechanics (MM), with which one can simulate a biomolecular system efficiently enough and meaningfully e…
cond-mat.mtrl-sci2024★ 28 cited
Revealing the molecular structures of a-Al2O3(0001)-water interface by machine learning based computational vibrational spectroscopy
Xianglong Du, Weizhi Shao, Chenglong Bao +3
Solid-water interfaces are crucial to many physical and chemical processes and are extensively studied using surface-specific sum-frequency generation (SFG) spectroscopy. To establ…