A New Approach to the Evaluation of Ther
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Takeshi Kikuchi
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Article
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2000
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Elsevier Science
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English
β 133 KB
We present a new approach to evaluating the intracrystalline thermodynamic properties of solid solutions by combining the molecular dynamics (MD) method and a chemical thermodynamic approach. The coordination type of ions in alkali halide solid solutions (A, B)X is classi5ed into 7 types X n (n β«Ψβ¬