How Evenly Can Approximate Density Functionals Treat the Different Multiplicities and Ionization States of 4d Transition Metal Atoms?

标题
How Evenly Can Approximate Density Functionals Treat the Different Multiplicities and Ionization States of 4d Transition Metal Atoms?
作者
关键词
-
出版物
Journal of Chemical Theory and Computation
Volume 8, Issue 11, Pages 4112-4126
出版商
American Chemical Society (ACS)
发表日期
2012-08-28
DOI
10.1021/ct300737t

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