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Calculation of the differential photoionization cross-section of PH3

Academic Article
Publication Date:
1999
abstract:
Cross-sections, photoelectron angular distribution parameters and branching ratios for the ionization of the outer-valence 5a(1), 2e and inner-valence 4a(1) shells of phosphine have been calculated up to a photon energy of 90 eV. Ab-initio calculations have been performed, by the K-matrix technique and projection on basis sets of L-2 functions, in the random phase approximation for the three coupled ionization channels. The theoretical results, compared with the available experimental data and with recent semi-empirical calculations, show a quantitative agreement with the experiment. (C) 1999 Elsevier Science B.V. All rights reserved.
Iris type:
01.01 Articolo in rivista
Keywords:
RANDOM-PHASE-APPROXIMATION; ONE-CENTER EXPANSION; L2 BASIS FUNCTIONS; ASYMMETRY PARAMETERS; STIELTJES TECHNIQUE; PHOTON ENERGY; VALENCE SHELL; H2O; MOLECULES; SPECTROSCOPY
List of contributors:
Carravetta, Vincenzo
Handle:
https://iris.cnr.it/handle/20.500.14243/199440
Published in:
CHEMICAL PHYSICS
Journal
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