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A New Uniform Phase Bridge Functional:Test and Its Application to Non—uniform Phase Fluid

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摘要 A new bridge functional as a function of indirect correlation function was proposed, which was basedon analysis on the asymptotic behavior of the Ornstein-Zernike (OZ) equation system and a series expansion whoserenormalization resulted in an adjustable parameter determined by the thermodynamics consistency condition. Theproposed bridge functional was tested by applying it to bulk hard sphere and hard core Yukawa fluid for the predictionof structure and thermodynamics properties based on the OZ equation. As an application, the present bridge functionalwas employed for non-uniform fluid of the above two kinds by means of the density functional theory methodology, theresulting density distribution profiles were in good agreement with the available computer simulation data.
出处 《Communications in Theoretical Physics》 SCIE CAS CSCD 2003年第2期231-237,共7页 理论物理通讯(英文版)
基金 国家自然科学基金,Scientific Research Fund of EducationDepartment of Hunan Province of China
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