Theoretical prediction of atomic volume for liquid metals based on the hard sphere model combined with NFE theory

A. Mizuno, T. Masaki, T. Itami

研究成果: Article査読

2 被引用数 (Scopus)

抄録

The volume of liquid metals was theoretically calculated based on the hard sphere model immersed in the uniform background potential of electron gas. The electron-ion interaction was approximated by a simple empty core model pseudopotential. The effect of entropy was taken into account for the evaluation of the volume of liquids. The calculated atomic volume is in good agreement with the experimental volume for liquid metals investigated even for liquid group 14 elements.

本文言語English
ページ(範囲)337-342
ページ数6
ジャーナルChemical Physics Letters
363
3-4
DOI
出版ステータスPublished - 2002 9 9
外部発表はい

ASJC Scopus subject areas

  • 物理学および天文学(全般)
  • 物理化学および理論化学

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