A New Approach to the Evaluation of Ther
โ
Takeshi Kikuchi
๐
Article
๐
2000
๐
Elsevier Science
๐
English
โ 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 โซุโฌ