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Liquid crystal phase diagram of the Gay-Berne fluid by density functional theory

 

作者: VALERIY V. GINZBURG,   MATTHEW A. GLASER,   NOEL A. CLARK,  

 

期刊: Liquid Crystals  （Taylor Available online 1997）
卷期: Volume 23, issue 2  

页码: 227-234

 

ISSN:0267-8292

 

年代: 1997

 

DOI:10.1080/026782997208488

 

出版商: Taylor & Francis Group

 

数据来源: Taylor

 

摘要:

We calculate the liquid crystal phase diagram for a model fluid with Gay-Berne interparticle potential using the Tarazona smoothed-density approximation of density functional theory. Vapour, liquid, nematic and smectic A phases are considered. For length to breadth ratio kappa 3 and energy anisotropy kappa 5, comparison with the simulation data of de Miguel et al. shows reasonable agreement.

 

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