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http://hdl.handle.net/10016/6989
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| Title: | Fundamental-measure density functional for mixtures of parallel hard cylinders |
| Author(s): | Martínez-Ratón, Yuri Capitán, José A. Cuesta, José A. |
| Publisher: | The American Physical Society |
| Issued date: | May-2008 |
| Citation: | Physical Review E 77, 051205 (2008) |
| URI: | http://hdl.handle.net/10016/6989 |
| ISSN: | 1539-3755 |
| DOI: | 10.1103/PhysRevE.77.051205 |
| Description: | 9 pages, 4 figures.-- PACS nrs.: 61.20.Gy, 61.30.Cz.-- ArXiv pre-print available at: http://arxiv.org/abs/0803.2033 Final publisher version available Open Access at: http://gisc.uc3m.es/~cuesta/papers-year.html |
| Abstract: | We obtain a fundamental-measure density functional for mixtures of parallel hard cylinders. For this purpose we first generalize to multicomponent mixtures the fundamental-measure functional proposed by Tarazona and Rosenfeld for a one-component hard disk fluid, through a method alternative to the cavity formalism of those authors. We show the equivalence of both methods when applied to two-dimensional fluids. The density functional so obtained reduces to the exact density functional for one-dimensional mixtures of hard rods when applied to one-dimensional profiles. In a second step, we apply an idea put forward some time ago by two of us, based again on a dimensional reduction of the system, and derive a density functional for mixtures of parallel hard cylinders. We explore some features of this functional by determining the fluid-fluid demixing spinodals for a binary mixture of cylinders with the same volume, and by calculating the direct correlation functions. |
| Sponsor: | Y.M.-R. is supported by a Ramón y Cajal research contract. J.A. Capitán acknowledges financial support through a contract from Consejería de Educación of Comunidad de Madrid and Fondo Social Europeo. This work is part of research projects MOSAICO of the Ministerio de Educación y Ciencia (Spain), and MOSSNOHO of Comunidad Autónoma de Madrid (Spain). |
| Review: | PeerReviewed |
| Publisher version: | http.//dx.doi.org/10.1103/PhysRevE.77.051205 |
| Keywords: | [PACS] Theory and models of liquid structure [PACS] Molecular and microscopic models and theories of liquid crystal structure |
| Rights: | © The American Physical Society |
| Appears in Collections: | DM - GISC - Artículos de Revistas
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