Ab initio intermolecular energies between Li+ and H2 near the van der waals minimum: comparison between a perturbative procedure and an SCF supermolecule treatment
- 15 October 1974
- journal article
- Published by Elsevier in Chemical Physics Letters
- Vol. 28 (4) , 471-476
- https://doi.org/10.1016/0009-2614(74)80081-3
Abstract
No abstract availableKeywords
This publication has 10 references indexed in Scilit:
- Use of biorthogonal orbitals in perturbation calculation of molecular interactions from a multiconfigurational unperturbed state. IIThe Journal of Chemical Physics, 1974
- Dispersion energy between two neon atoms from an ab initio perturbative procedureChemical Physics Letters, 1974
- Use of biorthogonal orbitals in calculation by perturbation of molecular interactionsThe Journal of Chemical Physics, 1973
- Perturbation theories for the calculation of molecular interaction energies. I. General formalismThe Journal of Chemical Physics, 1973
- Evaluation of the intermolecular energy between two hydrogen molecules near the van der Waals minimum, from a perturbative procedureThe Journal of Chemical Physics, 1973
- Computed potential hypersurface (including electron correlation) of the system Li+/H2Chemical Physics, 1973
- Interaction Potential between Li+ and H2. II. Region Appropriate for Vibrational ExcitationThe Journal of Chemical Physics, 1971
- Variational calculations of the static polarizability of H2and of the dipole-dipole contribution to the dispersion energy between two hydrogen moleculesMolecular Physics, 1971
- Intermolecular forces using spatial eigenfunctionsChemical Physics Letters, 1969
- Theory of Weak Atomic and Molecular InteractionsPhysical Review B, 1967