論文

査読有り
2014年3月

Thermal Conductivity of Molten Alkali Metal Fluorides (LiF, NaF, KF) and Their Mixtures

JOURNAL OF PHYSICAL CHEMISTRY B
  • Yoshiki Ishii
  • ,
  • Keisuke Sato
  • ,
  • Mathieu Salanne
  • ,
  • Paul A. Madden
  • ,
  • Norikazu Ohtori

118
12
開始ページ
3385
終了ページ
3391
記述言語
英語
掲載種別
研究論文(学術雑誌)
DOI
10.1021/jp411781n
出版者・発行元
AMER CHEMICAL SOC

The thermal conductivities of molten alkali fluorides (LiF, NaF, and KF) and their mixtures (LiF NaF, LiF KF, and NaF-KF binaries and LiF NaF KF ternary) are predicted using molecular dynamics simulation with the Green-Kubo method. A polarizable ion model is used to describe the interionic interactions. All the systems except LiF KF and LiF NaF-KF mixtures follow a scaling law: it is proportionnal to m(A)(-1/2)(N/V)(2/3), where m(A) is the arithmetic average of the ionic species masses in a given melt and N is the total number of ions included in the system volume V. In LiF KF and LiF-NaF-KF mixtures a significant departure from the scaling law is observed. By examining separately the effects of the cation mass and size asymmetry in LiF KF mixtures, we show that both of them account for half of the deviation. Finally, we observe that the temperature dependence of the thermal conductivity is very small in these molten fluorides.

リンク情報
DOI
https://doi.org/10.1021/jp411781n
Web of Science
https://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcAuth=JSTA_CEL&SrcApp=J_Gate_JST&DestLinkType=FullRecord&KeyUT=WOS:000333578000016&DestApp=WOS_CPL
ID情報
  • DOI : 10.1021/jp411781n
  • ISSN : 1520-6106
  • Web of Science ID : WOS:000333578000016

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