Ab initio force constants for the HCN molecule: SCF and CI results
- U. Wahlgren
- J. Pacansky
- et al.
- 2008
- The Journal of Chemical Physics
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Potential energy surface for the model unimolecular reaction HNC→HCN
- Peter K. Pearson
- Henry F. Schaefer III
- et al.
- 2008
- The Journal of Chemical Physics
Direct correlation function: Hard sphere fluid
- Douglas Henderson
- E.W. Grundke
- 2008
- The Journal of Chemical Physics
Surface, subsurface, and bulk exciton transitions of crystalline anthracene
- M.R. Philpott
- J.M. Turlet
- 2008
- The Journal of Chemical Physics
A theoretical study of the electronic structure of ferrocene and ferricinium: Application to Mössbauer isomer shifts, ionization potentials, and conformation
- P.S. Bagus
- U.I. Walgren
- et al.
- 2008
- The Journal of Chemical Physics
Nonadiabatic effects in the collision of F(2P) with H 2(1Σg+). II. Born-Oppenheimer and angular momentum coupling in adiabatic and diabatic representations
- Frank Rebentrost
- William A. Lester Jr.
- 2008
- The Journal of Chemical Physics
A polarized single crystal Raman study of the librational phonons in p-diiodobenzene
- S.P. Cramer
- B. Hudson
- et al.
- 2008
- The Journal of Chemical Physics
Coupled-channel study of rotational excitation of a rigid asymmetric top by atom impact: (H2CO,He) at interstellar temperatures
- Barbara J. Garrison
- William A. Lester Jr.
- et al.
- 2008
- The Journal of Chemical Physics
Three-body effects in the exchange and dissociation encounters for Ar+Ar2
- Robert E. Howard
- Robert E. Roberts
- et al.
- 2008
- The Journal of Chemical Physics
Study of the structure of molecular complexes. XIII. Monte Carlo simulation of liquid water with a configuration interaction pair potential
- George C. Lie
- E. Clementi
- et al.
- 2008
- The Journal of Chemical Physics