f-Type functions in the orbital basis for calculating molecular interactions involving d electrons Cr2 and Mo2
- A.D. McLean
- B. Liu
- 1983
- Chemical Physics Letters
Publications
Date
Featured collections
Popular topics
89 results for B. Liu
The binding energy of the ground state of Be2
- B.H. Lengsfield III
- A.D. McLean
- 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
Theoretical study of the AlO blue-green (B2∑+-X2∑+ band system
- H. Partridge
- Stephen R. Langhoff
- et al.
- 1983
- Journal of Quantitative Spectroscopy and Radiative Transfer
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
Ab initio potential curve for the b 3Σ- state of CH+
- Roberta P. Saxon
- B. Liu
- 1983
- The Journal of Chemical Physics
An orthogonal orbital MCSCF plus Cl treatment of molecular symmetry breaking. I. The lowest 3B2 and 3A2 states of CO2
- L. Engelbrecht
- B. Liu
- 1983
- The Journal of Chemical Physics
An ab initio study of core-valence correlation
- Harry Partridge
- Charles W. Bauschlicher Jr.
- et al.
- 1983
- The Journal of Chemical Physics
D- production by charge transfer of (0.3 - 3)-keV D+ in thick alkaline-earth vapor targets: Interaction energies for CaH+, CaH, and CaH-
- R.H. McFarland
- A.S. Schlachter
- et al.
- 1982
- Physical Review A
Theoretical study of NH2: Potential curves, transition moments, and photodissociation cross sections
- Roberta P. Saxon
- Byron H. Lengsfield III
- et al.
- 1982
- The Journal of Chemical Physics