On the configuration interaction method for singlet states
- 1 January 1976
- journal article
- Published by Springer Nature in Theoretical Chemistry Accounts
- Vol. 43 (2) , 197-205
- https://doi.org/10.1007/bf00547259
Abstract
No abstract availableKeywords
This publication has 9 references indexed in Scilit:
- A b i n i t i o SCF and CI studies on the ground state of the water molecule. I. Comparison of CGTO and STO basis sets near the Hartree–Fock limitThe Journal of Chemical Physics, 1975
- SCF-CI studies of correlation effects on hydrogen bonding and ion hydrationTheoretical Chemistry Accounts, 1975
- The iterative calculation of a few of the lowest eigenvalues and corresponding eigenvectors of large real-symmetric matricesJournal of Computational Physics, 1975
- The configuration interaction method, and the triplet-singlet splitting in CH2Theoretical Chemistry Accounts, 1975
- The iterative calculation of several of the lowest or highest eigenvalues and corresponding eigenvectors of very large symmetric matricesJournal of Computational Physics, 1973
- A new method for large-scale Cl calculationsChemical Physics Letters, 1972
- Gaussian Basis Functions for Use in Molecular Calculations. III. Contraction of (10s6p) Atomic Basis Sets for the First-Row AtomsThe Journal of Chemical Physics, 1971
- Variation-Perturbation Expansions and Padé Approximants to the EnergyPhysical Review A, 1970
- Algorithm for Diagonalization of Large MatricesThe Journal of Chemical Physics, 1965