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Various functionals for the kinetic energy density of an atom or molecule

Data up to Jan 2025

Published1986
Citations125
References25

Total Citations Per Year

Abstract

References (25)

Roothaan-Hartree-Fock atomic wavefunctions

1974 • 5,462 citations

Universal variational functionals of electron densities, first-order density matrices, and natural spin-orbitals and solution of the v -representability problem

1979 • 1,817 citations

Theory of the Inhomogeneous Electron Gas

1983 • 1,481 citations

Density Functional Theory

1983 • 539 citations

Accurate Density Functional for the Energy: Real-Space Cutoff of the Gradient Expansion for the Exchange Hole

1985 • 468 citations

"Schrödinger inequalities" and asymptotic behavior of the electron density of atoms and molecules

1977 • 336 citations

Quantum Corrections to the Thomas–Fermi Approximation—The Kirzhnits Method

1973 • 312 citations

Transcription of ground-state density-functional theory into a local thermodynamics.

1984 • 246 citations

Semiclassical approximations for nuclear hamiltonians. I. Spin-independent potentials

1979 • 214 citations

Sixth-order term of the gradient expansion of the kinetic-energy density functional

1981 • 143 citations

Gradient correction in Thomas-Fermi theory

1986 • 140 citations

Gradient expansion of the atomic kinetic energy functional

1976 • 100 citations

On the Weizsäcker Correction to the Thomas-Fermi Theory of the Atom

1965 • 95 citations

Solution of the Thomas-Fermi-Dirac Equation with a Modified Weizsäcker Correction

1966 • 94 citations

Comparative study of the gradient expansion of the atomic kinetic energy functional‐neutral atoms

1980 • 90 citations

Local asymptotic gradient corrections to the energy functional of an electron gas

1985 • 50 citations

Study of the kinetic energy density functional in the locally linear potential approximation

1985 • 48 citations

Hartree-Fock densities in Thomas-Fermi-Dirac formulas including the inhomogeneity term

1976 • 46 citations

The gradient expansions of the kinetic energy and the mean momentum for light diatomic molecules

1985 • 42 citations

Density-gradient expansion of the kinetic-energy functional for molecules

1986 • 34 citations

Gradient expansion of the kinetic energy density functional: Local behavior of the kinetic energy density

1979 • 26 citations

Gradient corrections in the energy density functional

1978 • 23 citations

Fourth-order gradient expansion of the fermion kinetic energy: Extra terms for nonanalytic densities

1986 • 21 citations

A kinetic energy density functional

1985 • 17 citations

Local behavior of the kinetic energy in density functional theory

1985 • 13 citations

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Various functionals for the kinetic energy density of an atom or molecule (1986) – Physical review. A, General physics | Metascience Observatory Explorer