First-Principles Calculation of Water pKa Using the Newly Developed SCAN Functional

标题
First-Principles Calculation of Water pKa Using the Newly Developed SCAN Functional
作者
关键词
-
出版物
Journal of Physical Chemistry Letters
Volume 11, Issue 1, Pages 54-59
出版商
American Chemical Society (ACS)
发表日期
2019-12-14
DOI
10.1021/acs.jpclett.9b02913

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