Approximate one-electron density matrix functionals for the electron–electron repulsion energy from the hypervirial theorem
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.477021
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2. Generalizations of the Hohenberg-Kohn theorem: I. Legendre Transform Constructions of Variational Principles for Density Matrices and Electron Distribution Functions;The Journal of Chemical Physics;2006-02-07
3. Generalized density-functional theory: Conquering theN-representability problem with exact functionals for the electron pair density and the second-order reduced density matrix;Journal of Chemical Sciences;2005-09
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