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Applications of photoelectron spectroscopy to molecular propertles: XVIII. The vertlcal ionization potentials of diphosphene as calculated by perturbation corrections to koopmans' theorem

โœ Scribed by D. Gonbeau; G. Pfister-Guillouzo


Publisher
Elsevier Science
Year
1984
Tongue
English
Weight
322 KB
Volume
33
Category
Article
ISSN
0368-2048

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Calculation of the vertical ionization p
โœ Stephen R. Langhoff; Delano P. Chong ๐Ÿ“‚ Article ๐Ÿ“… 1982 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 291 KB

The vcrtlcat lonlz;lhon pokntlalsof Or\*, HNrz and Cl12r2 wcrc colnputcd by Raylclgb-SLhrodlnfcr purturbatlon corrcchons to Koopmans' theorem. Compxrlson of the rvcragc absolute devlatlon of 21 lomzahon potcnt!dls from c\pcrlmcnt lndlcates ngndiunt nnprovcmcnt over prcvlous large-scale frozcn-orbnal