Publications

954 results at The Journal of Chemical Physics

Percus-Yevick equation of state for the square-well fluid at high densities
- - William R. Smith
  - Douglas Henderson
  - et al.
- 2003
- The Journal of Chemical Physics
Interatomic potentials for krypton and xenon
- - J.A. Barker
  - R.O. Watts
  - et al.
- 2003
- The Journal of Chemical Physics
Electronic structure of unstable intermediates. I. the electronic structure of some linear triatomic molecules containing boron
- - Colin Thomson
- 2003
- The Journal of Chemical Physics
Use of nonrelativistic wavefunctions for the prediction of properties of molecules containing atoms of high Z. PbO as a test case
- - Gretchen M. Schwenzer
  - Dean H. Liskow
  - et al.
- 2003
- The Journal of Chemical Physics
Self-consistent phonon calculation of the β phase and the α-β transition in solid nitrogen
- - J.C. Raich
  - N.S. Gillis
  - et al.
- 2003
- The Journal of Chemical Physics
Simple basis sets for molecular wavefunctions containing atoms from Z = 2 to Z = 54
- - Caria Roetti
  - Enrico Clementi
- 2003
- The Journal of Chemical Physics
Theory and Monte Carlo simulation of physical clusters in the imperfect vapor
- - K. Lee
  - J.A. Barker
  - et al.
- 2003
- The Journal of Chemical Physics
Study of the structure of molecular complexes. III. Energy surface of a water molecule in the field of a fluorine or chlorine anion
- - H. Kistenmacher
  - H. Popkie
  - et al.
- 2003
- The Journal of Chemical Physics
Ab initio potential energy surface for linear H₃
- - B. Liu
- 2003
- The Journal of Chemical Physics
PNO-CI studies of electron correlation effects. I. Configuration expansion by means of nonorthogonal orbitals, and application to the ground state and ionized states of methane
- - Wilfried Meyer
- 2003
- The Journal of Chemical Physics