A density-functional study for the liquid-vapor coexistence curve of nitrogen fluid

Tomonari Sumi, Hideaki Shirahama, Hideo Sekino

研究成果査読

2 被引用数 (Scopus)

抄録

The density functional theory for correlation of homonuclear diatomic fluids to predict the liquid vapor coexistence curve of nitrogen fluid was investigated. The pressure and chemical potential was calculated using thermodynamic integrations of the isotherm compressibility and of the excess internal energy. The predicted liquid-vapor coexistence curves and their diameters in scaled temperatures are studied. The two predictions from the thermodynamic integrations provide different equilibrium densities. It was found that the thermodynamic integration with T s=300K provided the better prediction of the liquid-vapor coexistence curves of N2.

本文言語English
ページ(範囲)1014-1019
ページ数6
ジャーナルJournal of Chemical Physics
121
2
DOI
出版ステータスPublished - 7月 8 2004
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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