(Q34465086)

2 August 2017

title

Exchange-correlation functional with broad accuracy for metallic and nonmetallic compounds, kinetics, and noncovalent interactions (English)

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2 August 2017

Yan Zhao

1

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2 August 2017

Nathan E Schultz

series ordinal

2

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2 August 2017

D G Truhlar

series ordinal

3

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2 August 2017

language of work or name

English

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publication date

1 October 2005

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Journal of Chemical Physics

2 August 2017

published in

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2 August 2017

volume

123

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2 August 2017

issue

16

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2 August 2017

page(s)

161103

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Density-functional approximation for the correlation energy of the inhomogeneous electron gas

2 August 2017

cites work

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Density-functional exchange-energy approximation with correct asymptotic behavior

21 January 2018

1 reference

Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

21 January 2018

1 reference

Accurate and simple analytic representation of the electron-gas correlation energy

21 January 2018

1 reference

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

21 January 2018

1 reference

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

21 January 2018

1 reference

Development of density functionals for thermochemical kinetics

21 January 2018

1 reference

Hybrid Meta Density Functional Theory Methods for Thermochemistry, Thermochemical Kinetics, and Noncovalent Interactions: The MPW1B95 and MPWB1K Models and Comparative Assessments for Hydrogen Bonding and van der Waals Interactions

21 January 2018

1 reference

Design of Density Functionals That Are Broadly Accurate for Thermochemistry, Thermochemical Kinetics, and Nonbonded Interactions

21 January 2018

1 reference

Databases for Transition Element Bonding: Metal−Metal Bond Energies and Bond Lengths and Their Use To Test Hybrid, Hybrid Meta, and Meta Density Functionals and Generalized Gradient Approximations

21 January 2018

1 reference

Effectiveness of Diffuse Basis Functions for Calculating Relative Energies by Density Functional Theory

21 January 2018

1 reference

New exchange-correlation density functionals: The role of the kinetic-energy density

21 January 2018

1 reference

21 January 2018

Identifiers

DOI

10.1063/1.2126975

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2 August 2017

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