Indirect nuclear spin-spin coupling constants within the coupled multiconfiguration hartree-fock approximation
- 1 December 1980
- journal article
- Published by Elsevier in Chemical Physics Letters
- Vol. 76 (2), 354-358
- https://doi.org/10.1016/0009-2614(80)87040-0
Abstract
No abstract availableThis publication has 15 references indexed in Scilit:
- Time-dependent multiconfigurational Hartree–Fock theoryThe Journal of Chemical Physics, 1980
- A quadratically convergent reference state optimization procedureChemical Physics Letters, 1979
- A multiconfigurational time-dependent hartree-fock approachChemical Physics Letters, 1979
- Convergency studies of second and approximate second order multiconfigurational Hartree−Fock proceduresThe Journal of Chemical Physics, 1979
- Optimization of orbitals for multiconfigurational reference statesThe Journal of Chemical Physics, 1978
- First order calculations of spin densities in ClO2-4 and ClO4Chemical Physics Letters, 1971
- Theoretical Investigation of the Lowest Double-Minimum State E, F 1Σg+ of the Hydrogen MoleculeThe Journal of Chemical Physics, 1969
- Vibrational and Rotational Energies for the B 1Σu + , C 1Πu, and a 3Σg + States of the Hydrogen MoleculeThe Journal of Chemical Physics, 1968
- Potential-Energy Curves for the X 1Σg+, b3Σu+, and C 1Πu States of the Hydrogen MoleculeThe Journal of Chemical Physics, 1965
- Electron Coupled Interactions between Nuclear Spins in MoleculesPhysical Review B, 1953