Applications of the direct SCF direct static-exchange method are reviewed for three different types of systems (fret molecules, polymers, and surface adsorbates) and for six types of spectroscopy (X-ray absorption-, -emission-, and -shake-up spectroscopy: ultraviolet photoelectron emission, X-ray Raman and circular dichroism spectroscopy.

Direct SCF direct static-exchange calculations of electronic spectra

Carravetta V;
1997

Abstract

Applications of the direct SCF direct static-exchange method are reviewed for three different types of systems (fret molecules, polymers, and surface adsorbates) and for six types of spectroscopy (X-ray absorption-, -emission-, and -shake-up spectroscopy: ultraviolet photoelectron emission, X-ray Raman and circular dichroism spectroscopy.
1997
direct methods
excited states
oligomers
adsorbates
X-ray spectra
X-RAY-EMISSION
HARTREE-FOCK CALCULATIONS
FIELD WAVE-FUNCTIONS
PHOTOELECTRON-SPECTRA
CONJUGATED MOLECULES
SURFACE-ADSORBATES
THIN-FILMS
SHAKE-UP
K-EDGES
PHOTOABSORPTION
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/20.500.14243/199419
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