On damping in self-consistency cycling procedures
- 1 January 1969
- journal article
- Published by Springer Nature in Theoretical Chemistry Accounts
- Vol. 14 (2) , 136-146
- https://doi.org/10.1007/bf00528230
Abstract
No abstract availableKeywords
This publication has 12 references indexed in Scilit:
- Approximate Self-Consistent Molecular Orbital Theory. III. CNDO Results for AB2 and AB3 SystemsThe Journal of Chemical Physics, 1966
- Semiempirical Molecular Orbital Calculations. I. The Electronic Structure of H2O and H2SThe Journal of Chemical Physics, 1966
- Comparisons of the Hückel and Pariser-Parr-Pople-type MO methods: Closed forms for SCF charge distributions and bond ordersTheoretical Chemistry Accounts, 1966
- Molecular Orbital Theory of Spectra of Cr3+ Ions in CrystalsThe Journal of Chemical Physics, 1963
- Basicities of the Methyl Benzenes. I. Hyperconjugation in the LCAO-MO FrameworkJournal of the American Chemical Society, 1961
- The density matrix in self-consistent field theory I. Iterative construction of the density matrixProceedings of the Royal Society of London. Series A. Mathematical and Physical Sciences, 1956
- Hyperconjugation and Spectrum of the Benzenium Ion, Prototype of Aromatic Carbonium Ions1Journal of the American Chemical Society, 1954
- A Semi-Empirical Theory of the Electronic Spectra and Electronic Structure of Complex Unsaturated Molecules. I.The Journal of Chemical Physics, 1953
- Electron interaction in unsaturated hydrocarbonsTransactions of the Faraday Society, 1953
- The Dipole Moments of Fulvene and AzuleneThe Journal of Chemical Physics, 1949