Spline Implementation of Generalized Gradient Approximations to the Exchange-Correlation Functional and Study of the Sensitivity of Density Functional Accuracy to Localized Domains of the Reduced Density Gradient

标题
Spline Implementation of Generalized Gradient Approximations to the Exchange-Correlation Functional and Study of the Sensitivity of Density Functional Accuracy to Localized Domains of the Reduced Density Gradient
作者
关键词
-
出版物
Journal of Chemical Theory and Computation
Volume 7, Issue 12, Pages 3983-3994
出版商
American Chemical Society (ACS)
发表日期
2011-10-28
DOI
10.1021/ct2006192

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