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Thermodynamically Consistent Theory of Classical Liquid Structure and Inverse Problem of Extracting Pair Potential

 

作者: N.H. March,   G. Senatore,  

 

期刊: Physics and Chemistry of Liquids  (Taylor Available online 1984)
卷期: Volume 13, issue 4  

页码: 285-292

 

ISSN:0031-9104

 

年代: 1984

 

DOI:10.1080/00319108408080787

 

出版商: Taylor & Francis Group

 

数据来源: Taylor

 

摘要:

The direct correlation functionc(r)is divided into two parts, following the work of Kumaret al.One part,c(r)potential≡cp(r), contributes the entire compressibility and decays at largeras-(r)/KBT, with (r) the density independent pair potential. The definition ofcp(r) as–(r)/KBT{(1/6ρr2)∂2/∂ρ∂r[ρ2r3g(r)]{ is motivated by the condition of thermodynamic consistency, and for a hard core liquid leads tocp(r) small inside an atomic diameter.

 

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