Ab Initio Calculations of Partial Charges at Kaolinite Edge Sites and Molecular Dynamics Simulations of Cation Adsorption in Saline Solutions at and above the pH of Zero Charge

标题
Ab Initio Calculations of Partial Charges at Kaolinite Edge Sites and Molecular Dynamics Simulations of Cation Adsorption in Saline Solutions at and above the pH of Zero Charge
作者
关键词
-
出版物
Journal of Physical Chemistry C
Volume 123, Issue 37, Pages 22971-22980
出版商
American Chemical Society (ACS)
发表日期
2019-08-30
DOI
10.1021/acs.jpcc.9b05339

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