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Proposed approximate relation in inhomogeneous electron liquids between exchange-only potential and its Slater counterpart
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Author
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Abstract
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We consider here exchange-only density functional theory. The search for the exchange-only potential Vx(r) involves either the optimal effective potential, or as an approximate alternative, calculating corrections to the Slater (Sl) potential GPCH_A_465167_O_XML_IMAGES\GPCH_A_465167_O_ILM0001.gif = 2ex(r)/n(r), ex(r) and n(r) being, respectively, the exchange energy density due to Dirac and the ground-state electron density. The Levy-Perdew virial-like integral relation between the total exchange energy and the gradient of Vx(r) is an important element in the present proposal. |
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Language
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English
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Source (journal)
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Physics and chemistry of liquids. - London
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Publication
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London
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2010
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ISSN
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0031-9104
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Volume/pages
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48
:5
(2010)
, p. 648-651
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ISI
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000283689800009
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Full text (Publisher's DOI)
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