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- W2117733708 endingPage "064601" @default.
- W2117733708 startingPage "064601" @default.
- W2117733708 abstract "A model molecular crystalline GeI4 was examined using molecular dynamics simulation. The model was constructed in such a way that rigid tetrahedral molecules interact with each other via Lennard-Jones potentials whose centers are located at the vertices of a tetrahedron. Because no other interaction that can “soften” the intermolecular interaction was introduced, the melting curve of the model crystalline material does not exhibit the anomaly that was found for the real substance. However, the current investigation is useful in that it could settle the upper bound of pressure below which the model can predict properties of the molecular liquid. Moreover, singularity-free nature of the melting curve allowed us to analytically treat the melting curve in the light of the Kumari–Dass–Kechin equation. As a result, we could definitely conclude that the well-known Simon equation for the melting curve is merely an approximate expression. The condition for the validity of Simon’s equation was identified." @default.
- W2117733708 created "2016-06-24" @default.
- W2117733708 creator A5008807046 @default.
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- W2117733708 date "2015-06-15" @default.
- W2117733708 modified "2023-09-24" @default.
- W2117733708 title "Melting Behavior of a Model Molecular Crystalline GeI<sub>4</sub>" @default.
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- W2117733708 doi "https://doi.org/10.7566/jpsj.84.064601" @default.
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