(Q58228086)

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An exchange functional for accurate virtual orbital energies

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An exchange functional for accurate virtual orbital energies (English)

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author name string

F. R. Manby

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1

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P. J. Knowles

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2

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English

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publication date

22 April 2000

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published in

Journal of Chemical Physics

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volume

112

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issue

16

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page(s)

7002-7007

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cites work

Self-Consistent Equations Including Exchange and Correlation Effects

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https://api.crossref.org/works/10.1063%2F1.481298

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21 January 2018

A new mixing of Hartree–Fock and local density‐functional theories

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https://api.crossref.org/works/10.1063%2F1.481298

retrieved

21 January 2018

Density-functional thermochemistry. III. The role of exact exchange

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https://api.crossref.org/works/10.1063%2F1.481298

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21 January 2018

Density-functional exchange-energy approximation with correct asymptotic behavior

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reference URL

https://api.crossref.org/works/10.1063%2F1.481298

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21 January 2018

Exchange holes in inhomogeneous systems: A coordinate-space model

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21 January 2018

A perturbation theory using a local potential from Hartree–Fock orbitals

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https://api.crossref.org/works/10.1063%2F1.481298

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21 January 2018

Note on Exchange Phenomena in the Thomas Atom

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21 January 2018

Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen

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21 January 2018

A real-space perturbation theory for electronic correlation

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reference URL

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21 January 2018

Accurate and simple density functional for the electronic exchange energy: Generalized gradient approximation

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reference URL

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21 January 2018

Improving virtual Kohn–Sham orbitals and eigenvalues: Application to excitation energies and static polarizabilities

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reference URL

https://api.crossref.org/works/10.1063%2F1.481298

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21 January 2018

Development and assessment of new exchange-correlation functionals

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reference URL

https://api.crossref.org/works/10.1063%2F1.481298

retrieved

21 January 2018

Gaussian and other approximations to the first-order density matrix of electronic systems, and the derivation of various local-density-functional theories

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Crossref

reference URL

https://api.crossref.org/works/10.1063%2F1.481298

retrieved

21 January 2018

Identifiers

DOI

10.1063/1.481298

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(Q58228086)

An exchange functional for accurate virtual orbital energies

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