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

Self-Consistent Equations Including Exchange and Correlation Effects

1965 • 57,451 citations

Inhomogeneous Electron Gas

1964 • 48,242 citations

Self-interaction correction to density-functional approximations for many-electron systems

1981 • 19,782 citations

A Simplification of the Hartree-Fock Method

1951 • 4,355 citations

Calculated Electronic Properties of Metals

1978 • 2,787 citations

One-Particle Properties of an Inhomogeneous Interacting Electron Gas

1966 • 958 citations

Energy Band Structure of Copper

1963 • 837 citations

Magnetic Effects and the Hartree-Fock Equation

1951 • 729 citations

Über eine Approximation des Hartree-Fockschen Potentials Durch eine Universelle Potentialfunktion

1954 • 628 citations

Descriptions of exchange and correlation effects in inhomogeneous electron systems

1979 • 585 citations

Angle-resolved photoemission determination of the band structure and multielectron excitations in Ni

1980 • 361 citations

First-principles electronic structure of Si, Ge, GaP, GaAs, ZnS, and ZnSe. I. Self-consistent energy bands, charge densities, and effective masses

1981 • 331 citations

Experimental Band Structure and Temperature-Dependent Magnetic Exchange Splitting of Nickel Using Angle-Resolved Photoemission

1978 • 326 citations

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

1978 • 299 citations

Density-Functional Theory of Excitation Spectra of Semiconductors: Application to Si

1983 • 248 citations

Study of the density-gradient expansion for the exchange energy

1982 • 237 citations

Experimental Exchange-Split Energy-Band Dispersions for Fe, Co, and Ni

1980 • 219 citations

Orbital functional for exchange and correlation: self-interaction correction to the local density approximation

1979 • 169 citations

Potentials, band structures, and Fermi surfaces in the noble metals

1981 • 135 citations

Failure of the local exchange approximation in the evaluation of the<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msup><mml:mrow><mml:mi mathvariant="normal">H</mml:mi></mml:mrow><mml:mrow><mml:mo>−</mml:mo></mml:mrow></mml:msup></mml:mrow></mml:math>ground state

1977 • 129 citations

Non-muffin-tin and relativistic interaction effects on the electronic structure of noble metals

1982 • 116 citations

BNDPKG. A package of programs for the calculation of electronic energy bands by the LCGO method

1978 • 102 citations

Instability of stable negative ions in the Xα method or other local density functional schemes

1978 • 89 citations

Corrections to the Local Density Approximation: Gradient Expansion versus Wave-Vector Analysis for the Metallic Surface Problem

1977 • 86 citations

Self-consistent relativistic APW calculation of the electronic structure of niobium with a non-muffin-tin potential

1977 • 85 citations

Local Exchange-Correlation Potentials and the Fermi Surface of Copper

1972 • 70 citations

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

1981 • 58 citations

Self-interaction correction for energy band calculations: Application to LiCl

1982 • 57 citations

Fermi-surface radii in copper, silver, and gold

1982 • 57 citations

Gradient term in the Kohn-Sham exchange-correlation potential

1974 • 55 citations

Electronic structure of LiH and NaH

1975 • 50 citations

Investigations of nonlocal exchange and correlation effects in metals via the density-functional formalism

1974 • 45 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

Hartree-Fock energy bands by the orthogonalized-plane-wave method: Lithium hydride results

1979 • 33 citations

An alternative one-particle approach to exchange and correlation inN-electron systems

1982 • 28 citations

Angle-Resolved Photoemission and Band Structure of Copper

1983 • 21 citations

Prediction of the Fermi surface as a test of density-functional approximations to the self - energy

1976 • 18 citations

Local exchange and correlation potentials for electron scattering at solid surfaces

1982 • 17 citations

Self-consistent relativistic bandstructure for gold

1980 • 16 citations