Molecular MC–SCF calculations
- 1 May 1970
- journal article
- research article
- Published by Wiley in International Journal of Quantum Chemistry
- Vol. 4 (3) , 297-313
- https://doi.org/10.1002/qua.560040307
Abstract
No abstract availableKeywords
This publication has 28 references indexed in Scilit:
- Generalized Brillouin theorem for multiconfigurational SCF theoriesInternational Journal of Quantum Chemistry, 1969
- Correlation Energy in Atomic Systems. V. Degeneracy Effects for the Second-Row AtomsThe Journal of Chemical Physics, 1968
- Multi-configuration SCF calculationsSymposia of the Faraday Society, 1968
- Extended Hartree—Fock Wavefunctions: General Theory of Optimized-Valence Configurations and Its Application to Diatomic MoleculesThe Journal of Chemical Physics, 1967
- Extended Hartree—Fock Ground-State Wavefunctions for the Lithium MoleculeThe Journal of Chemical Physics, 1967
- Complete multi-configuration self-consistent field theoryTheoretical Chemistry Accounts, 1967
- Extended Hartree—Fock Wavefunctions: Optimized Valence Configurations for H2 and Li2, Optimized Double Configurations for F2The Journal of Chemical Physics, 1966
- Direct Determination of Natural Orbitals and Natural Expansion Coefficients of Many-Electron Wavefunctions. I. Natural Orbitals in the Geminal Product ApproximationThe Journal of Chemical Physics, 1964
- Some Recent Advances in Density Matrix TheoryReviews of Modern Physics, 1960
- Canonical Configurational Interaction ProcedureReviews of Modern Physics, 1960