(Q46789762)

25 December 2017

title

Efficient exact exchange approximations in density-functional theory (English)

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25 December 2017

author name string

Hesselmann A

series ordinal

1

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Manby FR

series ordinal

2

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language of work or name

English

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publication date

1 October 2005

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25 December 2017

Journal of Chemical Physics

published in

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25 December 2017

volume

123

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issue

16

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page(s)

164116

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

cites work

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Simple iterative construction of the optimized effective potential for orbital functionals, including exact exchange.

21 January 2018

1 reference

Exchange methods in Kohn-Sham theory.

21 January 2018

1 reference

Exchange holes in inhomogeneous systems: A coordinate-space model

21 January 2018

1 reference

Poisson equation in the Kohn-Sham Coulomb problem.

21 January 2018

1 reference

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

21 January 2018

1 reference

Density-functional exchange-energy approximation with correct asymptotic behavior

21 January 2018

1 reference

True stabilization energies for the optimal planar hydrogen-bonded and stacked structures of guanine...cytosine, adenine...thymine, and their 9- and 1-methyl derivatives: complete basis set calculations at the MP2 and CCSD(T) levels and comparison w

21 January 2018

1 reference

The Poisson equation in density fitting for the Kohn-Sham Coulomb problem

21 January 2018

1 reference

Fast Hartree–Fock theory using local density fitting approximations

21 January 2018

1 reference

Fast linear scaling second-order Møller-Plesset perturbation theory (MP2) using local and density fitting approximations

21 January 2018

1 reference

21 January 2018

Identifiers

DOI

10.1063/1.2072887

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25 December 2017

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25 December 2017