The calculation of frequency-dependent polarizabilities as pseudo-energy derivatives
- Julia E. Rice
- Nicholas C. Handy
- 1991
- The Journal of Chemical Physics
Paper
Publications
954 results at The Journal of Chemical Physics
A critical examination of data on the dissociative adsorption and associative desorption of hydrogen at copper surfaces
- H.A. Michelsen
- D.J. Auerbach
- 1991
- The Journal of Chemical Physics
PaperStructural and electronic properties of sodium microclusters (n=2-20) at low and high temperatures: New insights from ab initio molecular dynamics studies
- Ursula Röthlisberger
- Wanda Andreoni
- 1991
- The Journal of Chemical Physics
PaperDynamics of the chemisorption of O2 on Pt(111): Dissociation via direct population of a molecularly chemisorbed precursor at high incidence kinetic energy
- C.T. Rettner
- C.B. Mullins
- 1991
- The Journal of Chemical Physics
PaperInfluence of monomer architecture on the shear properties of molecularly thin polymer melts
- A. Homola
- H. Nguyen
- et al.
- 1991
- The Journal of Chemical Physics
PaperBonding geometry and bonding character of thiocyanate adsorbed on a Ag(100) surface
- Gianfranco Pacchioni
- Francesc Illas
- et al.
- 1991
- The Journal of Chemical Physics
PaperOrientation and absolute coverage of furan and 2,5-dihydrofuran on Ag(110) determined by near edge x-ray absorption fine structure and x-ray photoelectron spectroscopy
- J. Solomon
- R.J. Madix
- et al.
- 1991
- The Journal of Chemical Physics
PaperMolecular dynamics algorithm for multiple time scales: Systems with disparate masses
- Mark E. Tuckerman
- Bruce J. Berne
- et al.
- 1991
- The Journal of Chemical Physics
PaperOn the nature of trapping and desorption at high surface temperatures. Theory and experiments for the Ar-Pt(111) system
- Martin Head-Gordon
- John C. Tully
- et al.
- 1991
- The Journal of Chemical Physics
PaperHydrogen bonding and the static dielectric constant in liquid water
- Michiel Sprik
- 1991
- The Journal of Chemical Physics
Paper