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The reduced density gradient in atoms

✍ Scribed by Jorge M. del Campo; José L. Gázquez; Rodrigo J. Alvarez-Mendez; Alberto Vela


Book ID
112185775
Publisher
John Wiley and Sons
Year
2012
Tongue
English
Weight
236 KB
Volume
112
Category
Article
ISSN
0020-7608

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We present an analysis of local or semilocal density functionals for the Ž exchange᎐correlation energy by decomposing them into their gradients r local Seitz s . Ž . Ž . radius , relative spin polarization , and s reduced density gradient . We explain the numerical method pertaining to this kind of