Local behavior of the kinetic energy in density functional theory

Inhomogeneous Electron Gas

1964 • 48,242 citations

Roothaan-Hartree-Fock atomic wavefunctions

1974 • 5,462 citations

Zur Theorie der Kernmassen

1935 • 2,066 citations

Descriptions of exchange and correlation effects in inhomogeneous electron systems

1979 • 585 citations

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

1973 • 312 citations

Nonlocal approximation to the exchange potential and kinetic energy of an inhomogeneous electron gas

1978 • 299 citations

Thomas-Fermi Theory Revisited

1973 • 235 citations

On the Quantum‐Mechanical Kinetic Energy as a Measure of the Information in a Distribution

1980 • 232 citations

Density Functional Calculations for Atoms, Molecules and Clusters

1980 • 226 citations

Self-consistent calculation of the electronic structure of small jellium spheres

1984 • 192 citations

The kinetic energy of molecular charge distributions and molecular stability

1969 • 185 citations

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

1981 • 143 citations

An atomic kinetic energy functional with full Weizsacker correction

1980 • 142 citations

Exchange and correlation in inhomogeneous electron systems

1977 • 141 citations

Local kinetic energy in quantum mechanics

1979 • 131 citations

New method for the direct calculation of electron density in many‐electron systems. I. Application to closed‐shell atoms

1983 • 118 citations

Gradient expansion of the atomic kinetic energy functional

1976 • 100 citations

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

1980 • 90 citations

A non-local approximation to the exchange energy of the non-homogeneous electron gas

1977 • 88 citations

On the atomic kinetic energy functionals with full Weizsacker correction

1982 • 88 citations

Nonlocal-density approximation to exchange and correlation: Effect on the silicon band structure

1981 • 58 citations

On the functional derivative of the kinetic energy density functional

1982 • 52 citations

On the nature of the correction to the Weizsacker term

1982 • 47 citations

Nonlocal density approximation to exchange and correlation in self-consistent bandstructure calculations: Application to Cu

1984 • 47 citations

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

1976 • 46 citations

Nonlocal exchange and correlation and semiconductor band structure

1983 • 43 citations

Nonlocal density approximation to exchange in relativistic-augmented-plane-wave band-structure calculations and consistent interpretation of photoemission data on Rh(110)

1981 • 43 citations

The weizsacker term in density functional theory

1981 • 43 citations

Origins—The Thomas-Fermi Theory

1983 • 31 citations

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

1979 • 26 citations

Asymptotic form of first-order density matrix for atoms and molecules

1981 • 25 citations

Thomas–Fermi term as the simplest correction to the Weizsacker term

1983 • 23 citations

Gradient corrections in the energy density functional

1978 • 23 citations

Two-parameter statistical model for atoms

1978 • 21 citations

Introduction of the shell structure into the Thomas—Fermi energy density functional for neutral atoms

1981 • 17 citations

Electronegativity of positive ions in the density functional theory

1982 • 17 citations

Comparative study of the gradient expansion of the atomic kinetic energy functional–isoelectronic series

1980 • 13 citations

Density Functional theory of the atomic electronegativity

1981 • 11 citations

Electronegativity of fractionally charged atoms in the Density Functional Theory

1983 • 6 citations

Atomic kinetic energy functional in density functional theory

1983 • 5 citations

Behavior of the local kinetic energy in the representation of the gradient expansion

1981 • 3 citations