論文

2017年3月1日

Molecular dynamics simulation of the soret effect in a CaSiO3 glass melt

Journal of the Ceramic Society of Japan
  • Masahiro Shimizu
  • Hiroshi Kato
  • Masayuki Nishi
  • Daisuke Hanakawa
  • Kohji Nagashima
  • Heidy Visbal
  • Hiroki Itasaka
  • Masaaki Sakakura
  • Yasuhiko Shimotsuma
  • Kiyotaka Miura
  • Kazuyuki Hirao
  • 全て表示

125
3
開始ページ
180
終了ページ
184
記述言語
英語
掲載種別
研究論文(学術雑誌)
DOI
10.2109/jcersj2.16187
出版者・発行元
Ceramic Society of Japan

The mole fraction distributions of CaO and SiO2 under a temperature gradient in a CaSiO3 melt were calculated by molecular dynamics. The temperatures at the cold and hot ends of the gradient were 1800 and 2200K, respectively, in the simulation. We used two sets of potential parameters proposed by Matsui et al. and Seo et al. The simulation results obtained with the two potentials indicate that the mole fraction of CaO in the cold region was higher than that in the hot region, and the mole fraction of SiO2 in the hot region was higher than that in the cold region. This is qualitatively consistent with previous experimental results obtained by laser local heating inside a CaSiO3 glass.

リンク情報
DOI
https://doi.org/10.2109/jcersj2.16187
ID情報
  • DOI : 10.2109/jcersj2.16187
  • ISSN : 1348-6535
  • ISSN : 1882-0743
  • SCOPUS ID : 85016054454

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