Reduced local energy as a criterion for the accuracy of approximate Hartree–Fock wave functions. Application to H2O and CH4
- 1 May 1982
- journal article
- research article
- Published by Wiley in International Journal of Quantum Chemistry
- Vol. 21 (5) , 885-897
- https://doi.org/10.1002/qua.560210514
Abstract
No abstract availableKeywords
This publication has 8 references indexed in Scilit:
- The complete active space SCF (CASSCF) method in a Newton–Raphson formulation with application to the HNO moleculeThe Journal of Chemical Physics, 1981
- Reduced local energy as a criterion for the accuracy of approximate H2 wave‐functionsInternational Journal of Quantum Chemistry, 1977
- New formula to estimate the ground state energy, EThe Journal of Chemical Physics, 1976
- MC-SCF. I. The multi-configuration self-consistent-field methodThe Journal of Chemical Physics, 1973
- Ab Initio Computations in Atoms and MoleculesIBM Journal of Research and Development, 1965
- Local-Energy Method in Electronic Energy CalculationsReviews of Modern Physics, 1960
- The Approximate Solution of Schrödinger Equations by a Least Squares MethodThe Journal of Chemical Physics, 1942
- The Helium Wave EquationPhysical Review B, 1937