Excited states of MgO: A cluster model study
- P.S. Bagus
- F. Illas
- et al.
- 1994
- The Journal of Chemical Physics
Publications
954 results at The Journal of Chemical Physics
Integrating the Car-Parrinello equations. I. Basic integration techniques
- Mark E. Tuckerman
- Michele Parrinello
- 1994
- The Journal of Chemical Physics
Dynamic displacement of O2 from Pt(111): A new desorption mechanism
- C.T. Rettner
- J. Lee
- 1994
- The Journal of Chemical Physics
Anisotropic rigid rotor potential energy function for H2O-H 2
- Timothy R. Phillips
- Sergio Maluendes
- et al.
- 1994
- The Journal of Chemical Physics
Equilibrium and dynamic properties of polymethylene melts from molecular dynamics simulations. I. n-tridecane
- Grant D. Smith
- Do Y. Yoon
- 1994
- The Journal of Chemical Physics
Swelling effects in semidilute block copolymer solutions
- Anne M. Mayes
- John G. Barker
- et al.
- 1994
- The Journal of Chemical Physics
Crossed beam rovibrational energy transfer from S1 glyoxal. IV. Reduced mass effects and an overview of the inelastic scattering characteristics from four initial levels
- Brian D. Gilbert
- Charles S. Parmenter
- et al.
- 1994
- The Journal of Chemical Physics
Dissociation of methane and ethane on Pt(110): Evidence for a direct mechanism under thermal conditions
- A.C. Luntz
- Harold F. Winters
- 1994
- The Journal of Chemical Physics
Vibrationally assisted electronic desorption: Femtosecond surface chemistry of O2/Pd(111)
- J. Misewich
- A. Kalamarides
- et al.
- 1994
- The Journal of Chemical Physics
Exponential transformation of molecular orbitals
- Jürg Hutter
- Michele Parrinello
- et al.
- 1994
- The Journal of Chemical Physics