Broken-symmetry hartee-fock description of deep core and outer valence hole states: The 3dσu and 4dσu hole states of Ag2+
- 1 April 1983
- journal article
- Published by Elsevier in Chemical Physics Letters
- Vol. 96 (2) , 183-191
- https://doi.org/10.1016/0009-2614(83)80489-8
Abstract
No abstract availableKeywords
This publication has 38 references indexed in Scilit:
- Symmetry adapted versus symmetry broken wavefunctions: the 1s core level ions of O+2Chemical Physics Letters, 1981
- Broken orbital-symmetry and the description of hole states in the tetrahedral [CrO4]− anion. I. Introductory considerations and calculations on oxygen 1s hole statesChemical Physics, 1981
- Ab initio Hartree-Fock calculations of molecular X-ray intensities. Validity of one-center approximationsTheoretical Chemistry Accounts, 1981
- Role of localization in the prediction of core ESCA lineshapes of N2, O2 and NOChemical Physics, 1979
- Theoretical study of the 400 eV core-excited valence states of N2The Journal of Chemical Physics, 1979
- Molecular-Photoelectron Angular Distributions as a Probe of Dynamic Symmetry BreakingPhysical Review Letters, 1978
- All-electron CI calculations for core-ionized, core-valence excited and shake-up states of N2Chemical Physics Letters, 1977
- A study of the core electron binding energies of ozone by x-ray photoelectron spectroscopy and the Xα scattered wave methodChemical Physics Letters, 1977
- Localized and delocalized core holes and their interrelationThe Journal of Chemical Physics, 1977
- Localized and Delocalized 1s Hole States of the O 2 + Molecular IonThe Journal of Chemical Physics, 1972