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

Published 2012 View Full Article

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Title
How Evenly Can Approximate Density Functionals Treat the Different Multiplicities and Ionization States of 4d Transition Metal Atoms?
Authors
Keywords
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Journal
Journal of Chemical Theory and Computation
Volume 8, Issue 11, Pages 4112-4126
Publisher
American Chemical Society (ACS)
Online
2012-08-28
DOI
10.1021/ct300737t

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