The ab initio calculation of defect energetics in aluminium

Special points for Brillouin-zone integrations

1976 • 61,084 citations

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

1981 • 19,782 citations

Ground State of the Electron Gas by a Stochastic Method

1980 • 13,746 citations

Unified Approach for Molecular Dynamics and Density-Functional Theory

1985 • 10,277 citations

Efficacious Form for Model Pseudopotentials

1982 • 5,519 citations

Pseudopotentials that work: From H to Pu

1982 • 3,300 citations

Calculation of the vacancy formation energy in aluminium

1989 • 496 citations

Self-interstitial atoms in metals

1978 • 247 citations

Computer simulation of defects in ionic solids

1990 • 166 citations

Measurements of the vacancy formation enthalpy in aluminum using positron annihilation spectroscopy

1978 • 156 citations

Analysis of tracer and nuclear magnetic resonance measurements of self‐diffusion in aluminium

1971 • 104 citations

The volume of formation of defects in ionic crystals

1981 • 94 citations

The use of a pair potential for the study of defects and disorder in aluminium

1981 • 84 citations

Vacancy formation energies and linear screening theory

1976 • 75 citations

Electron and positron response to atomic defects in solids: A theoretical study of the monovacancy and divacancy in aluminum

1983 • 75 citations

Calculation of the free energy of defects in calcium fluoride

1985 • 68 citations

Effect of Pressure on Quenched-In Electrical Resistance in Gold and Aluminum

1969 • 63 citations

Self-consistent electronic structure of a vacancy in aluminum

1981 • 36 citations

Pseudo-atom calculation of energetics in metals

1989 • 25 citations

k-point sampling and the k.p method in pseudopotential total energy calculations

1990 • 20 citations

Extension of the muffin-tin Green's-function theory of defects: Application to defects in aluminum

1984 • 16 citations

Vacancy induced residual resistance in ultrarapidly quenched pure aluminum

1970 • 10 citations

Propriétés des défauts ponctuels dans les métaux c.f.c., hexagonaux et cubiques centrés

1988 • 6 citations