論文

査読有り
2014年4月

Computer simulations of the two-species model for the melting curve maximum

MOLECULAR SIMULATION
  • H. Shimizu
  • ,
  • Y. Hiwatari

40
5
開始ページ
370
終了ページ
378
記述言語
英語
掲載種別
研究論文(学術雑誌)
DOI
10.1080/08927022.2013.812207
出版者・発行元
TAYLOR & FRANCIS LTD

The existence of extrema, maximum and/or minimum and negative gradients of melting curves observed for several elements at high pressure is investigated by molecular dynamics simulation using the two-species model (TSM) proposed by Ogura et al. [1]. TSM is a model which imitates the change in the electronic structure of an atom in terms of a species change in particles. The TSM phase diagram has two solid phases and one liquid phase with a solid-solid-liquid triple point which corresponds to the melting curve minimum. The melting curve has both a maximum and a minimum, and the gradient of the melting curve is negative between these extrema. These peculiar melting curve properties and phase diagram are common to alkali metals and some other elements.

リンク情報
DOI
https://doi.org/10.1080/08927022.2013.812207
Web of Science
https://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcAuth=JSTA_CEL&SrcApp=J_Gate_JST&DestLinkType=FullRecord&KeyUT=WOS:000329487200005&DestApp=WOS_CPL
ID情報
  • DOI : 10.1080/08927022.2013.812207
  • ISSN : 0892-7022
  • eISSN : 1029-0435
  • Web of Science ID : WOS:000329487200005

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