(Q56776316)

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Linear scaling computation of the Hartree–Fock exchange matrix

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Linear scaling computation of the Hartree–Fock exchange matrix (English)

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author name string

Eric Schwegler

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1

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Matt Challacombe

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2

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language of work or name

English

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publication date

15 August 1996

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published in

Journal of Chemical Physics

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volume

105

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issue

7

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page(s)

2726-2734

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cites work

New Developments in Molecular Orbital Theory

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reference URL

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21 January 2018

Electronic Wave Functions. I. A General Method of Calculation for the Stationary States of Any Molecular System

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21 January 2018

One- and two-electron integrals over cartesian gaussian functions

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21 January 2018

Efficient recursive computation of molecular integrals over Cartesian Gaussian functions

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21 January 2018

Unconstrained minimization approach for electronic computations that scales linearly with system size

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21 January 2018

Orbital formulation for electronic-structure calculations with linear system-size scaling

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21 January 2018

Density-matrix electronic-structure method with linear system-size scaling

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21 January 2018

Self-consistent first-principles technique with linear scaling

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21 January 2018

Fast assembly of the Coulomb matrix: A quantum chemical tree code

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21 January 2018

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

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21 January 2018

Analytic Properties of Bloch Waves and Wannier Functions

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21 January 2018

Approximate Formulas for Many‐Center Integrals in the Theory of Molecules and Crystals

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21 January 2018

Linear-scaling density-functional-theory technique: The density-matrix approach

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21 January 2018

Dual-space approach for density-functional calculations of two- and three-dimensional crystals using Gaussian basis functions

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21 January 2018

Identifiers

DOI

10.1063/1.472135

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(Q56776316)

Linear scaling computation of the Hartree–Fock exchange matrix

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