Torsional Tunneling Splitting in a Water Trimer-Reference-Cited by-同舟云学术

Torsional Tunneling Splitting in a Water Trimer

Published:2022-11-09 Issue:46 Volume:144 Page:21356-21362
ISSN:0002-7863
Container-title:Journal of the American Chemical Society
language:en
Short-container-title:J. Am. Chem. Soc.

Author:

Zhu Yu-Cheng¹²^ORCID,Yang Shuo³⁴,Zeng Jia-Xi¹²,Fang Wei³⁵^ORCID,Jiang Ling³^ORCID,Zhang Dong H.³^ORCID,Li Xin-Zheng¹²⁶^ORCID

Affiliation:

1. State Key Laboratory for Artificial Microstructure and Mesoscopic Physics, Frontier Science Center for Nano-optoelectronics and School of Physics, Peking University, Beijing100871, People’s Republic of China

2. Interdisciplinary Institute of Light-Element Quantum Materials, Research Center for Light-Element Advanced Materials, and Collaborative Innovation Center of Quantum Materials, Peking University, Beijing100871, People’s Republic of China

3. State Key Laboratory of Molecular Reaction Dynamics, Dalian Institute of Chemical Physics, Chinese Academy of Sciences, Dalian116023, People’s Republic of China

4. University of Chinese Academy of Sciences, Beijing100871, People’s Republic of China

5. Department of Chemistry, Fudan University, Shanghai200438, People’s Republic of China

6. Peking University Yangtze Delta Institute of Optoelectronics, Nantong, Jiangsu226010, People’s Republic of China

Funder

Ministry of Science and Technology of the People's Republic of China

Natural Science Foundation of Beijing Municipality

National Natural Science Foundation of China

Chinese Academy of Sciences

Publisher

American Chemical Society (ACS)

Subject

Colloid and Surface Chemistry,Biochemistry,General Chemistry,Catalysis

Link

https://pubs.acs.org/doi/pdf/10.1021/jacs.2c09909

Reference43 articles.

1. Predictions of the Properties of Water from First Principles

2. Spectroscopic Determination of the Water Pair Potential

3. Getting the Right Answers for the Right Reasons: Toward Predictive Molecular Simulations of Water with Many-Body Potential Energy Functions

4. Toward a Universal Water Model: First Principles Simulations from the Dimer to the Liquid Phase

5. Development of a “First Principles” Water Potential with Flexible Monomers: Dimer Potential Energy Surface, VRT Spectrum, and Second Virial Coefficient

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