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Journal of Thermal Analysis and Calorimetry

, Volume 81, Issue 3, pp 559–562 | Cite as

Molecular dynamics simulation of the phase behavior of AgI1-xClx

  • S. Hamakawa
  • M. Aniya
  • F. Shimojo
Article

Summary

The temperature and pressure dependencies of the structure and transport properties of AgI1-xClx are studied by means of molecular dynamics. From the results of the calculations, the P-T phase diagram for the AgI0.8Cl0.2 system has been obtained. The phase diagram indicates that the superionic phase transition temperature increase with the application of pressure. It is also pointed out that AgI1-xClx has a tendency of phase separation.

phase diagram superionic conductors AgI1-xClx molecular dynamics 

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Copyright information

© Springer-Verlag/Akadémiai Kiadó 2005

Authors and Affiliations

  • S. Hamakawa
    • 1
  • M. Aniya
    • 2
  • F. Shimojo
    • 3
  1. 1.Graduate School of Science and Technology, Kumamoto University
  2. 2.Department of Physics, Faculty of Science, Kumamoto University
  3. 3.Department of Physics, Faculty of Science, Kumamoto University

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