On the contribution of orbital relaxation to ESCA chemical shifts
- 1 November 1970
- journal article
- Published by Elsevier in Chemical Physics Letters
- Vol. 7 (3) , 323-324
- https://doi.org/10.1016/0009-2614(70)80172-5
Abstract
No abstract availableKeywords
This publication has 5 references indexed in Scilit:
- Comparison of Core-Level Binding Energy Shifts in Molecules with Predictions Based on Koopmans' TheoremThe Journal of Chemical Physics, 1970
- Direct calculation of binding energies of inner-shell electrons in moleculesChemical Physics Letters, 1970
- ESCA: chemical shifts of K-shell electron binding energies for first-row atoms in moleculesChemical Physics Letters, 1969
- Atomic electron populations by molecular orbital theorySymposia of the Faraday Society, 1968
- Ab Initio Computations in Atoms and MoleculesIBM Journal of Research and Development, 1965