Molecular Dynamics Studies of Superionic Conductors.Interionic Potential and Ion-Conducting Phase
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概要
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As a simple model for a-Agl, a system with ionic potentials consisting of onlya Coulombic and a soft-core repulsive terms is investigated with use of a moleculardynamics method. The system has interesting scaling properties and is characterizedby the ratio of the ion core radii and F, 'the ratio of potential strengths betweenthe Coulombic and soft-core terms. It is shown that there exists a range of T inwhich the iodine sublattice forms a stable bcc structure and silver tons arc dis-ordered. The F- and temperature dependences of various quantities are examined.In this range of T the diffusion and the density distribution of silver ions are inaccord with the experiments.
- 社団法人日本物理学会の論文
- 1982-12-15
著者
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Ueda Akira
Department Of Applied Mathematics And Physics Faculty Of Engineering Kyoto University
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Hiwatari Yasuaki
Department Of Computational Science Kanazawa University
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FUKUMOTO Atsuo
Department of Applied Mathematics and Physics,Faculty of Engineering,Kyoto University
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Fukumoto Atsuo
Department Of Applied Mathematics And Physics Faculty Of Engineering Kyoto University
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Hiwatari Yasuaki
Department Of Computational Science Faculty Of Science Kanazawa University
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Hiwatari Yasuaki
Department of Physics,Faculty of Science,Kanazawa University
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