Publications

954 results at The Journal of Chemical Physics

On the Mott-Cabrera oxidation rate equation and the inverse-logarithmic law
- - Richard Ghez
- 2003
- The Journal of Chemical Physics
Near infrared absorption spectrum of HO₂
- - H.E. Hunziker
  - H.R. Wendt
- 2003
- The Journal of Chemical Physics
On the SCF-LCAO-MO and the SCF-Xa-SW approximations: Computation of the barrier to internal rotation for ethane
- - E. Clementi
  - H. Kistenmacher
  - et al.
- 2003
- The Journal of Chemical Physics
CHarge transfer equilibria in TTF-TCNQ solutions
- - Y. Tomkiewicz
  - J.B. Torrance
  - et al.
- 2003
- The Journal of Chemical Physics
Analytical Hartree-Fock wavefunctions for the neutral atoms from helium to xenon
- - Carla Roetti
  - Enrico Clementi
- 2003
- The Journal of Chemical Physics
Ionic and covalent electronic states for K adsorbed on Cu₅ and Cu₂₅ cluster models of the Cu(100) surface
- - Paul S. Bagus
  - Gianfranco Pacchioni
- 1995
- The Journal of Chemical Physics
Ab initio molecular dynamics of H₂O adsorbed on solid MgO
- - Walter Langel
  - Michele Parrinello
- 1995
- The Journal of Chemical Physics
An optimized united atom model for simulations of polymethylene melts
- - Wolfgang Paul
  - Do Y. Yoon
  - et al.
- 1995
- The Journal of Chemical Physics
Integrating the Car-Parrinello equations. III. Techniques for ultrasoft pseudopotentials
- - Jürg Hutter
  - Mark Tuckerman
  - et al.
- 1995
- The Journal of Chemical Physics
Hydrogen on polycrystalline diamond films: Studies of isothermal desorption and atomic deuterium abstraction
- - D.D. Koleske
  - S. Gates
  - et al.
- 1995
- The Journal of Chemical Physics