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Density-Functional Theory for Fractional Particle Number: Derivative Discontinuities of the Energy
journal-article
Author(s):
John P. Perdew
,
Robert G. Parr
,
Mel Levy
,
Jose L. Balduz
Publication date
(Electronic):
1982
Publisher:
American Physical Society (APS)
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There is no author summary for this article yet. Authors can add summaries to their articles on ScienceOpen to make them more accessible to a non-specialist audience.
Abstract
Physical Review Letters, 49(23), 1691-1694
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Electronegativity: The density functional viewpoint
Robert Parr
,
Robert A. Donnelly
,
Mel Levy
…
(1978)
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A New Electroaffinity Scale; Together with Data on Valence States and on Valence Ionization Potentials and Electron Affinities
Robert Mulliken
(1934)
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Calculation of ionization potentials from density matrices and natural functions, and the long-range behavior of natural orbitals and electron density
Marilyn M. Morrell
(1975)
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Author and article information
Journal
Publisher:
American Physical Society (APS)
Publication date (Electronic):
1982
Publication date (Issued):
06 December 1982
Publication date Updated:
15 June 2017
Article
DOI:
10.1103/PHYSREVLETT.49.1691
SO-VID:
91502536-fc4b-4b9b-98c9-fbafbdf10fb6
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scite_
Cited by
561
Comparative assessment of a new nonempirical density functional: Molecules and hydrogen-bonded complexes
Authors:
Viktor N. Staroverov
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Gustavo Scuseria
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Jianmin Tao
…
Maximally localized Wannier functions: Theory and applications
Authors:
Nicola Marzari
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Arash Mostofi
,
Jonathan R Yates
…
WIEN2k: An APW+lo program for calculating the properties of solids
Authors:
Peter Blaha
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Most referenced authors
287
X. Xu
S Yang
W Yang
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