The incorporation of quadratic convergence into open-shell self-consistent field equations
- 1 August 1970
- journal article
- research article
- Published by Elsevier in Chemical Physics Letters
- Vol. 6 (3) , 147-151
- https://doi.org/10.1016/0009-2614(70)80202-0
Abstract
No abstract availableThis publication has 13 references indexed in Scilit:
- The proper treatment of off-diagonal lagrange multipliers and coupling operators in self-consistent field equationsChemical Physics Letters, 1969
- The orthogonality constrained basis set expansion method for treating off-diagonal lagrange multipliers in calculations of electronic wave functionsChemical Physics Letters, 1969
- A General SCF FormalismProgress of Theoretical Physics, 1969
- Best Choice for the Coupling Operators in the Open-Shell and Multiconfiguration SCF MethodsThe Journal of Chemical Physics, 1968
- Multi-Configuration Self-Consistent-Field TheoryProgress of Theoretical Physics Supplement, 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
- Self-Consistent-Field Theory. II. The LCAO ApproximationThe Journal of Chemical Physics, 1964
- Self-Consistent-Field Theory. I. General TreatmentThe Journal of Chemical Physics, 1963
- Self-Consistent Field Theory for Open Shells of Electronic SystemsReviews of Modern Physics, 1960