Calculation of Space Formations of Cation Polyhedra by Chemical Formula of Oxide

A. Korotkov, V. Atuchin
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Abstract

Universal method has been proposed for calculation of polyhedra space formation of each cation in the crystal lattice. Generation of simple, chain, layer and frame formations has been predicted and verified for non-centrosymmetric oxide crystals widely used in nonlinear optics.
用氧化物化学式计算阳离子多面体的空间形成
提出了计算晶格中各阳离子多面体空间形成的通用方法。对非线性光学中广泛应用的非中心对称氧化物晶体的简单、链状、层状和框状结构的生成进行了预测和验证。
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