Algorithm for the determination of the equilibrium geometry of polyatomic molecules with automatic elimination of dependent coordinates

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Bibliographic Details
Published inJournal of structural chemistry Vol. 26; no. 4; pp. 525 - 530
Main Authors Shatokhin, S. A., Gribov, L. A., Perelygin, I. S.
Format Journal Article
LanguageEnglish
Published 01.01.1986
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ISSN:0022-4766
1573-8779
DOI:10.1007/BF00754123