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Thermodynamics of polar lattices

 

作者: D.E. Sullivan,   J.M. Deutch,   G. Stell,  

 

期刊: Molecular Physics  (Taylor Available online 1974)
卷期: Volume 28, issue 5  

页码: 1359-1371

 

ISSN:0026-8976

 

年代: 1974

 

DOI:10.1080/00268977400102641

 

出版商: Taylor & Francis Group

 

数据来源: Taylor

 

摘要:

The high-temperature series expansion for the free energy of a lattice of classical permanent dipoles is obtained to order (μ2/T)5, where μ is the dipole moment andTthe temperature. Numerical values of the coefficients in the series are presented for three cubic lattices. Two Padé approximants to the expansion are constructed which exhibit the appropriate low-temperature behaviour of the free energy. These approximants are compared with results of the spherical model for this system, and it is found that the simplest of these gives an accurate assessment of the exact low-temperature behaviour. The Padé approximant results for the free energy also agree quite well with the spherical model results. The implications of these observations for polar fluids are noted. A connection is presented between the free energy and the Clausius-Mossotti function for dipolar lattices. A Padé approximant to the Clausius-Mossotti function which is constructed to satisfy known bounds is found to agree with the spherical model results for this quantity.

 

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