Evaluating Charge Equilibration Methods To Generate Electrostatic Fields in Nanoporous Materials

标题
Evaluating Charge Equilibration Methods To Generate Electrostatic Fields in Nanoporous Materials
作者
关键词
-
出版物
Journal of Chemical Theory and Computation
Volume 15, Issue 1, Pages 382-401
出版商
American Chemical Society (ACS)
发表日期
2018-11-13
DOI
10.1021/acs.jctc.8b00669

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