Numerical MC SCF and CI calculations of the ground-state potential energy curve of N2
- 4 October 1985
- journal article
- Published by Elsevier in Chemical Physics Letters
- Vol. 120 (2) , 159-162
- https://doi.org/10.1016/0009-2614(85)87032-9
Abstract
No abstract availableKeywords
This publication has 9 references indexed in Scilit:
- The impact of higher polarization basis functions on molecular ab initio results. I. The ground state of F2The Journal of Chemical Physics, 1985
- Theoretical investigation of the low-lying electronic states of Cu, Zn, and their ionsThe Journal of Chemical Physics, 1985
- Temperature dependent collision-induced absorption in nitrogenCanadian Journal of Physics, 1984
- Self-consistent molecular orbital methods 25. Supplementary functions for Gaussian basis setsThe Journal of Chemical Physics, 1984
- The externally contracted CI method applied to N2International Journal of Quantum Chemistry, 1983
- Numerical solution of the restricted and multiconfiguration Hartree-Fock equations for diatomic moleculesThe Journal of Physical Chemistry, 1982
- Ab initio study of valence-state potential energy curves of nitrogenThe Journal of Physical Chemistry, 1982
- SCF and CI calculations of the one-electron properties, polarizabilities and polarizability derivatives of the nitrogen moleculeMolecular Physics, 1980
- Quadrupole moment of CO, N2, and NO+The Journal of Chemical Physics, 1974