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Photoelectron spectra of hydrogen peroxide and hydrogen disulphide: ab initio calculations

โœ Scribed by D.W. Davies

Publisher
Elsevier Science
Year
1974
Tongue
English
Weight
296 KB
Volume
28
Category
Article
ISSN
0009-2614

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โœฆ Synopsis

Kooprnans' theorem ionization potenti& from ab initio &~~sivl b;&s-t calculations on cis, tram and ske:v fofls of HOOH and HSSH ae cornpar@ with e);perimental values from phoioe!ectron spectroscopy.

'bden used to'inteipret the photoelectron spectra, +d ,+ -150.789225.

-796.168395 the eigenvectors and eigenvalues for the largest basis skew -150.80?921 -796.201512

sets ue not quoted. trnrrr -150.801776 -796.194691 Ail computations were made with the .+TMOL ', .

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