Potential energy integrals in semiempirical MO methods
- 1 March 1974
- journal article
- Published by Wiley in International Journal of Quantum Chemistry
- Vol. 8 (2), 263-266
- https://doi.org/10.1002/qua.560080213
Abstract
No abstract availableKeywords
This publication has 5 references indexed in Scilit:
- Semiempirical Molecular Orbital Calculations and Molecular Energies. A New Formula for the β ParameterJournal of the American Chemical Society, 1973
- Removal of core orbitals in ‘valence orbital only’ calculationsMolecular Physics, 1972
- Approximate Self-Consistent Molecular Orbital Theory. III. CNDO Results for AB2 and AB3 SystemsThe Journal of Chemical Physics, 1966
- Approximate Self-Consistent Molecular Orbital Theory. II. Calculations with Complete Neglect of Differential OverlapThe Journal of Chemical Physics, 1965
- On the Non-Orthogonality Problem Connected with the Use of Atomic Wave Functions in the Theory of Molecules and CrystalsThe Journal of Chemical Physics, 1950