Charge-Optimized Electrostatic Interaction Atom-Centered Neural Network Algorithm-Reference-Cited by-同舟云学术

Charge-Optimized Electrostatic Interaction Atom-Centered Neural Network Algorithm

Published:2024-02-21 Issue:5 Volume:20 Page:2088-2097
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Song Zichen¹²^ORCID,Han Jian²^ORCID,Henkelman Graeme³⁴^ORCID,Li Lei¹^ORCID

Affiliation:

1. Shenzhen Key Laboratory of Micro/Nano-Porous Functional Materials (SKLPM), Department of Materials Science and Engineering, Southern University of Science and Technology, Shenzhen 518055, China

2. Department of Materials Science and Engineering, City University of Hong Kong, Kowloon, Hong Kong, China

3. Department of Chemistry, the University of Texas at Austin, Austin, Texas 78712, United States

4. Institute for Computational Engineering and Sciences, the University of Texas at Austin, Austin, Texas 78712, United States

Funder

Division of Chemistry

Welch Foundation

Shenzhen Fundamental Research Program

National Natural Science Foundation of China

Shenzhen Key Laboratory of Micro/Nano-Porous Functional Materials

Publisher

American Chemical Society (ACS)

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.3c01254

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