Abstract
By the ab initio SCF MO LCAO method in a 3-21G basis and in the valence approximation of MNDO, the structure and conformation of Si(OH)4 and related systems have been investigated. The results are judged from the standpoint of the anomeric effect. Model structures are proposed for the buildup of extended silicate systems.
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Additional information
Institute of Geology of Ore Deposits, Petrography, Mineralogy, and Geochemistry, Academy of Sciences of the USSR, Moscow. Translated from Teoreticheskaya i Éksperimental'naya Khimiya, Vol. 27, No. 4, pp. 482–485, July–August, 1991. Original article submitted October 12, 1990.
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Lebedev, V.L., Dolin, S.P. Anomeric effect and structure of Si(OH)4 and related molecular systems. Theor Exp Chem 27, 421–423 (1991). https://doi.org/10.1007/BF01372521
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DOI: https://doi.org/10.1007/BF01372521