A direct method for obtaining cartesian coordinates of atoms in molecules

In the present paper a simple procedure for obtaining Cartesian coordinates of atoms in molecules is described. An evaluation of the performance of the

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Bibliographic Details
Published in:Computers & chemistry 1982, Vol.6 (4), p.193-195
Main Authors: Kornilov, M.Yu, Tolstukha, T.A., Kadziauskas, P., Butkus, E.
Format: Article
Language:English
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Description
Summary:In the present paper a simple procedure for obtaining Cartesian coordinates of atoms in molecules is described. An evaluation of the performance of the
ISSN:0097-8485
DOI:10.1016/0097-8485(82)85014-6