Seminumerical SCF calculations on small diatomic molecules
- 1 January 1974
- journal article
- Published by Elsevier in Chemical Physics Letters
- Vol. 24 (1), 55-58
- https://doi.org/10.1016/0009-2614(74)80212-5
Abstract
No abstract availableKeywords
This publication has 10 references indexed in Scilit:
- One-Center Molecular Calculations with Unlimited Radial Basis. H2, HeH+, and LiH Centered on One NucleusThe Journal of Chemical Physics, 1969
- He–He Interaction in the SCF–MO ApproximationThe Journal of Chemical Physics, 1968
- Single-Configuration Wavefunctions and Potential Curves for the Ground States of He2, Ne2, and Ar2The Journal of Chemical Physics, 1967
- Electronic Structure of Diatomic Molecules. VI.A. Hartree—Fock Wavefunctions and Energy Quantities for the Ground States of the First-Row Hydrides, AHThe Journal of Chemical Physics, 1967
- Hartree—Fock Parameters for the Atoms Helium to RadonThe Journal of Chemical Physics, 1966
- Cusp Conditions for Molecular WavefunctionsThe Journal of Chemical Physics, 1966
- Electronic structure and properties of the ions AlH4-and PH4+Proceedings of the Physical Society, 1966
- NUMERICAL SOLUTION OF THE HARTREE–FOCK EQUATIONSCanadian Journal of Physics, 1963
- Analytical Self-Consistent Field Functions for the Atomic Configurations , , andReviews of Modern Physics, 1960
- New Developments in Molecular Orbital TheoryReviews of Modern Physics, 1951