Fourth‐order diagrammatic MB–RSPT calculations of the correlation energy: N2, CO, F2 and the reaction energy of the process ½F2 + ½H2 = HF
- 1 December 1980
- journal article
- research article
- Published by Wiley in International Journal of Quantum Chemistry
- Vol. 18 (6), 1431-1448
- https://doi.org/10.1002/qua.560180608
Abstract
No abstract availableKeywords
This publication has 53 references indexed in Scilit:
- Comments on the exclusion‐principle‐violating diagrams cancellation in correlations energy calculation by many‐body Rayleigh–Schrödinger perturbation theoryInternational Journal of Quantum Chemistry, 1980
- The quartic force field of H2O determined by many-body methods that include quadruple excitation effectsThe Journal of Chemical Physics, 1979
- Accurate binding energies of diborane, borane carbonyl, and borazane determined by many-body perturbation theoryJournal of the American Chemical Society, 1979
- Diagrammatic many-body perturbation expansion for atoms and molecules: IV. Fourth-order linked diagrams involving quadruply-excited statesComputer Physics Communications, 1979
- Many body perturbation calculations and coupled electron pair modelsComputer Physics Communications, 1979
- Correlation energy contributions to reaction heatsInternational Journal of Quantum Chemistry, 1977
- A semi‐empirical MO theory for ionization potentials and electron affinitiesInternational Journal of Quantum Chemistry, 1977
- Algebraic approximation in many-body perturbation theoryPhysical Review A, 1976
- PNO–CI (pair-natural-orbital configuration interaction) and CEPA–PNO (coupled electron pair approximation with pair natural orbitals) calculations of molecular systems. IV. The molecules N2, F2, C2H2, C2H4, and C2H6The Journal of Chemical Physics, 1975
- Note on an Approximation Treatment for Many-Electron SystemsPhysical Review B, 1934