(Q57566105)

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

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title

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

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author name string

A. Daniel Boese

series ordinal

1

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Nicholas C. Handy

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2

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language of work or name

English

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publication date

8 June 2002

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published in

Journal of Chemical Physics

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volume

116

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issue

22

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page(s)

9559-9569

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cites work

Accurate spin-dependent electron liquid correlation energies for local spin density calculations: a critical analysis

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21 January 2018

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

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Density-functional exchange-energy approximation with correct asymptotic behavior

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

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21 January 2018

Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation

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21 January 2018

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

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21 January 2018

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

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Gaussian‐2 theory for molecular energies of first‐ and second‐row compounds

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New generalized gradient approximation functionals

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A new parametrization of exchange–correlation generalized gradient approximation functionals

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Predicting the binding energies of H-bonded complexes: A comparative DFT study

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Exchange holes in inhomogeneous systems: A coordinate-space model

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Optimized Lieb-Oxford bound for the exchange-correlation energy

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Zur Theorie der Kernmassen

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Generalized Gradient Approximation Made Simple

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Comment on “Assessment of exchange correlation functionals” [A.J. Cohen, N.C. Handy, Chem. Phys. Lett. 316 (2000) 160–166]

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DOI

10.1063/1.1476309

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(Q57566105)

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

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