Publications

954 results at The Journal of Chemical Physics

Decomposition of the chemisorption bond by constrained variations: Order of the variations and construction of the variational spaces
- - Paul S. Bagus
  - Francesc Illas
- 1992
- The Journal of Chemical Physics
Accurate potential energy surface for Xe/Pt(111): A benchmark gas/surface interaction potential
- - J.A. Barker
  - C.T. Rettner
- 1992
- The Journal of Chemical Physics
Problems in the comparison of theoretical and experimental hyperpolarizabilities
- - Andrew Willetts
  - Julia E. Rice
  - et al.
- 1992
- The Journal of Chemical Physics
Experimental and theoretical study of H+HI→H₂+I reaction dynamics at 1.3 ev collision energy
- - Pamela M. Aker
  - Geoffrey J. Germann
  - et al.
- 1992
- The Journal of Chemical Physics
Frequency-dependent hyperpolarizabilities for argon, krypton, and neon: Comparison with experiment
- - Julia E. Rice
- 1992
- The Journal of Chemical Physics
Vanishing interfacial tension in an immiscible polymer blend
- - Kenneth R. Shull
  - Andrew J. Kellock
  - et al.
- 1992
- The Journal of Chemical Physics
The potential energy curves of the X ¹Σ_g⁺ ground states of Mg₂ and Ca₂ using the interacting correlated fragments model
- - K.G. Dyall
  - A.D. McLean
- 1992
- The Journal of Chemical Physics
Thirteen-atom clusters: Equilibrium geometries, structural transformations, and trends in Na, Mg, Al, and Si
- - Ursula Röthlisberger
  - Wanda Andreoni
  - et al.
- 1992
- The Journal of Chemical Physics
The role of tunneling in precursor mediated dissociation: Alkanes on metal surfaces
- - A.C. Luntz
  - J. Harris
- 1992
- The Journal of Chemical Physics
Self-consistent mean-field analysis of classical many-body systems at finite temperature
- - L.R. Logan
  - C.S. Murthy
  - et al.
- 1992
- The Journal of Chemical Physics