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Phase diagram of Gaussian-core nematics

2007/03/31 by Santi Prestipino, Franz Saija · 1 citation
Engineering · Materials Science · Physics and Astronomy · #Advanced Materials and Mechanics #Crystal (programming language) #Gaussian #Liquid Crystal Research Advancements #Liquid crystal #Material Dynamics and Properties #Phase (matter) #Phase diagram #Reentrancy #cond-mat.mtrl-sci #cond-mat.soft

paper · pdf · doi:10.1063/1.2737041

published as J. Chem. Phys. 126, 194902 (2007) · 15 pages, 1 table, 10 figures, submitted on J. Chem. Phys.

arxiv created 2007/03/31 · openalex publication_date 2007/05/17 · arxiv updated 2009/12/01 · openalex created_date 2016/06/24 · openalex updated_date 2026/08/05

Abstract

The authors study a simple model of a nematic liquid crystal made of parallel ellipsoidal particles interacting via a repulsive Gaussian law. After identifying the relevant solid phases of the system through a careful zero-temperature scrutiny of as many as eleven candidate crystal structures, they determine the melting temperature for various pressure values, also with the help of exact free energy calculations. Among the prominent features of this model are pressure-driven reentrant melting and the stabilization of a columnar phase for intermediate temperatures.

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