Parameter-free equation-of-state calculations for CsCaF₃

Roothaan-Hartree-Fock atomic wavefunctions

1974 • 5,462 citations

Explicit local exchange-correlation potentials

1971 • 3,266 citations

Theory for the Forces between Closed-Shell Atoms and Molecules

1972 • 1,250 citations

Relativistic self-consistent field program for atoms and ions

1971 • 459 citations

First-principles equation-of-state calculations for alkali halides

1981 • 138 citations

Phase transitions in RbCa<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">F</mml:mi></mml:mrow><mml:mrow><mml:mn>3</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math>

1974 • 99 citations

Theoretical study of the structural phase transition in RbCa<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">F</mml:mi></mml:mrow><mml:mrow><mml:mn>3</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math>

1981 • 84 citations

Approach to Melting in Ammonia as a Critical Transition

1982 • 49 citations

Thermal expansion of benzene at high pressure determined by a calorimetric method, its behavior near melting

1979 • 46 citations

Symmetrized Fourier method for interpolating band-structure results

1979 • 45 citations

Structural phase transitions in Kcaf₃- DSC, birefringence and neutron powder diffraction results

1980 • 39 citations

Low energy phonon dispersion curves of KZnF3 and CsCaF3

1981 • 35 citations

A new model for the phase transitions due to octahedra rotations in the perovskite structure

1979 • 33 citations

An Analysis of Thermal Expansion and Melting in Alkali Halides

1982 • 9 citations