Open AccessCNDO/2 Calculations of the Ionization Potentials and Electronic Spectra of Some Unsaturated Hydrocarbons
Author(s) -
Toshio Hayashi,
Takeshi Nakajima
Publication year - 1975
Publication title -
bulletin of the chemical society of japan
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.145
H-Index - 99
eISSN - 1348-0634
pISSN - 0009-2673
DOI - 10.1246/bcsj.48.980
Subject(s) - cndo/2 , chemistry , cyclobutene , cyclopentadiene , naphthalene , benzene , ionization , computational chemistry , ionization energy , spectral line , ethylene , organic chemistry , molecule , ion , ring (chemistry) , quantum mechanics , physics , catalysis
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