An isomeric reaction benchmark set to test if the performance of state-of-the-art density functionals can be regarded as independent of the external potential
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Title
An isomeric reaction benchmark set to test if the performance of state-of-the-art density functionals can be regarded as independent of the external potential
Authors
Keywords
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Journal
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Volume 16, Issue 28, Pages 14559
Publisher
Royal Society of Chemistry (RSC)
Online
2014-03-18
DOI
10.1039/c4cp00772g
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