AB initio calculations of oscillator and
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Thomas D. Bouman; Aage E. Hansen
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Article
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1978
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Elsevier Science
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English
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Minimal basis set (STO4G) ab initio calculations in the randomphase approximation (RPA) are presented for the ordinary and rotatory intensities of the low-Iying electronic transitions of twisted cis-butadiene. and planar trams-butadiene. The formally equivalent intensities agree much better in the R