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Theoretical studies of molecular complexes: a probe into basis set and correlation effects

✍ Scribed by Roman Osman; Sid Topiol; Harel Weinstein; James E. Eilers

Publisher: Elsevier Science
Year: 1980
Tongue: English
Weight: 420 KB
Volume: 73
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(80)80397-6

No coin nor oath required. For personal study only.

✦ Synopsis

We mvestlgate the effect of bans set size, correlatton effects and mterplamu separation on the theoretical electronic structure of stacking complexes of para-and meta-hydroxyamhne wth formamidmmm cation, constructed as analogs for the complexes of 5-and C-hydroxytryptamme wth unidazohum cation

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