Abstract
Using quantum-chemical models and calculation methods for microscopic theory of order disorder structural phase transitions in H-bonded solids is considered based on previous works. The general approach is discussed by analyzing the problem of the extremal dependence of these transitions on the type of the hydrogen isotope typical for a number of materials.
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Translated from Zhurnal Strukturnoi Khimii, Vol. 48, Supplement, pp. S142–S148, 2007.
Original Russian Text Copyright © 2007 by A. A. Levin, S. P. Dolin, and T. Yu. Mikhailova
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Levin, A.A., Dolin, S.P. & Mikhailova, T.Y. Extremal isotopic dependence of structural phase transitions in H-bonded materials: One problem in solid state quantum chemistry. J Struct Chem 48 (Suppl 1), S134–S140 (2007). https://doi.org/10.1007/s10947-007-0156-z
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DOI: https://doi.org/10.1007/s10947-007-0156-z