Publications

954 results at The Journal of Chemical Physics

Nonrelativistic all electron SCF, MCSCF, and Cl calculations on the AgH, AuH, and Ag₂ molecules
- - A.D. McLean
- 1983
- The Journal of Chemical Physics
Ab initio potential curve for the b ³Σ^- state of CH⁺
- - Roberta P. Saxon
  - B. Liu
- 1983
- The Journal of Chemical Physics
Nonradiative relaxation of electronically excited N₂ on Al(111). Comparison with nonlocal optical theory
- - Ph. Avouris
  - D. Schmeisser
  - et al.
- 1983
- The Journal of Chemical Physics
Formaldehyde: Ab initio MCSCF+Cl transition state for H₂CO→ CO+H₂ on the S₀ surface
- - M. Dupuis
  - W.A. Lester Jr.
  - et al.
- 1983
- The Journal of Chemical Physics
A photon correlation spectroscopy study of the dynamic behavior of poly(α-methylstyrene) in moderately concentrated solution
- - J.C. Selser
- 1983
- The Journal of Chemical Physics
Vibrational spectroscopy of mixed stack organic semiconductors: Neutral and ionic phases of tetrathiafulvalene-chloranil (TTF-CA) charge transfer complex
- - Alberto Girlando
  - Franca Marzola
  - et al.
- 1983
- The Journal of Chemical Physics
The application of the HNC/MSA approximation to bulk electrolytes
- - Douglas Henderson
  - Marcelo Lozada-Cassou
  - et al.
- 1983
- The Journal of Chemical Physics
The chemical and physical properties of pyrrole-based conducting polymers: The oxidation of neutral polypyrrole
- - P. Pfluger
  - M. Krounbi
  - et al.
- 1983
- The Journal of Chemical Physics
The convergence of the cluster model for the study of chemisorption: Be₃₆H
- - Paul S. Bagus
  - Henry F. Schaefer III
  - et al.
- 1983
- The Journal of Chemical Physics
Ab initio investigation of the 3Π states of NO⁺
- - Roberta P. Saxon
  - Debbie F.-T. Tuan
  - et al.
- 1983
- The Journal of Chemical Physics