How Interatomic Steps in the Exact Kohn–Sham Potential Relate to Derivative Discontinuities of the Energy

Published 2017 View Full Article

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Title
How Interatomic Steps in the Exact Kohn–Sham Potential Relate to Derivative Discontinuities of the Energy
Authors
Keywords
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Journal
Journal of Physical Chemistry Letters
Volume 8, Issue 24, Pages 5974-5980
Publisher
American Chemical Society (ACS)
Online
2017-11-28
DOI
10.1021/acs.jpclett.7b02615

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