Fragment interaction analysis of structural problems in the framework ofAb initio SCF-MO computations
- 1 April 1981
- journal article
- Published by Springer Nature in Theoretical Chemistry Accounts
- Vol. 58 (4) , 245-255
- https://doi.org/10.1007/bf02426902
Abstract
No abstract availableKeywords
This publication has 14 references indexed in Scilit:
- Molecular orbitals from group orbitals. IX. The problem of hybrid lone pairsCanadian Journal of Chemistry, 1979
- Quantitative nonempirical estimates of the effects of orbital interactions. Applications to difluoroethylenesJournal of the American Chemical Society, 1978
- Molecular orbitals from group orbitals. 6. Quantitative evaluation and nature of the stabilizing and destabilizing orbital interactions in difluoroethylenes and fluoropropenesJournal of the American Chemical Society, 1978
- Molecular orbitals from group orbitals. 3. Quantitative perturbational molecular orbital analysis of ab initio SCF-MO wave functionsJournal of the American Chemical Society, 1977
- A new energy decomposition scheme for molecular interactions within the Hartree‐Fock approximationInternational Journal of Quantum Chemistry, 1976
- SCF perturbation theory and intermolecular interactionsInternational Journal of Quantum Chemistry, 1972
- Self-consistent field intermolecular orbital theory of the interaction between conjugated systemsMolecular Physics, 1970
- Intermolecular orbital theory of the interaction between conjugated systems. I. General theoryJournal of the American Chemical Society, 1968
- General perturbation theory for the extendedMolecular Physics, 1968
- Construction of Some Molecular Orbitals to Be Approximately Invariant for Changes from One Molecule to AnotherReviews of Modern Physics, 1960