Full configuration interaction benchmark calculations for transition moments
Authors:
- 1 January 1988
- journal article
- research article
- Published by Springer Nature in Theoretical Chemistry Accounts
- Vol. 73 (1) , 43-53
Abstract
No abstract availableKeywords
This publication has 13 references indexed in Scilit:
- Theoretical study of the dipole moment function of OH(X 2Π)The Journal of Chemical Physics, 1987
- A full CI treatment of the 1A1–3B1 separation in methyleneThe Journal of Chemical Physics, 1986
- On the electron affinity of the oxygen atomThe Journal of Chemical Physics, 1986
- A modified coupled pair functional approachThe Journal of Chemical Physics, 1986
- The coupled pair functional (CPF). A size consistent modification of the CI(SD) based on an energy functionalThe Journal of Chemical Physics, 1985
- A new determinant-based full configuration interaction methodChemical Physics Letters, 1984
- Accurate ab initio calculations on the singlet-triplet separation in methyleneJournal of the American Chemical Society, 1978
- Correlation diagram for He + He → BeThe Journal of Chemical Physics, 1974
- Gaussian Basis Functions for Use in Molecular Calculations. I. Contraction of (9s5p) Atomic Basis Sets for the First-Row AtomsThe Journal of Chemical Physics, 1970
- Gaussian-Type Functions for Polyatomic Systems. IThe Journal of Chemical Physics, 1965