Hard-sphere and hard-disk freezing from the differential formulation of the generalized effective liquid approximation
| dc.contributor.author | Fernández Tejero, Carlos | |
| dc.contributor.author | Cuesta, J. A. | |
| dc.date.accessioned | 2023-06-20T18:54:05Z | |
| dc.date.available | 2023-06-20T18:54:05Z | |
| dc.date.issued | 1993-01 | |
| dc.description | © 1993 The American Physical Society. We are grateful to M. Baus for useful discussions. This work has been supported by the Dirección General de Investigación Científica y Técnica (DGICYT, Spain) (PB91-0378). | |
| dc.description.abstract | We apply the differential formulation of the generalized effective liquid approximation to the study of hard-sphere and hard-disk freezing. We show that the thermodynamic properties of the solid phase are rather insensitive to the compressibility factor of the fluid phase used to map the solid onto the effective liquid. The solid-fluid coexistence data instead are quite dependent on the equation of state describing the fluid phase. Very accurate results, as compared with the simulation data, are obtained for both the freezing of hard spheres and hard disks. | |
| dc.description.department | Depto. de Estructura de la Materia, Física Térmica y Electrónica | |
| dc.description.faculty | Fac. de Ciencias Físicas | |
| dc.description.refereed | TRUE | |
| dc.description.sponsorship | Dirección General de Investigación Científica y Técnica (DGICYT, Spain) | |
| dc.description.status | pub | |
| dc.eprint.id | https://eprints.ucm.es/id/eprint/23945 | |
| dc.identifier.doi | 10.1103/PhysRevE.47.490 | |
| dc.identifier.issn | 1063-651X | |
| dc.identifier.officialurl | http://dx.doi.org/10.1103/PhysRevE.47.490 | |
| dc.identifier.relatedurl | http://pre.aps.org/ | |
| dc.identifier.uri | https://hdl.handle.net/20.500.14352/58891 | |
| dc.issue.number | 1 | |
| dc.journal.title | Physical Review E | |
| dc.language.iso | eng | |
| dc.page.final | 495 | |
| dc.page.initial | 490 | |
| dc.publisher | American Physical Society | |
| dc.relation.projectID | PB91-0378 | |
| dc.rights.accessRights | open access | |
| dc.subject.cdu | 536 | |
| dc.subject.keyword | Density-Functional Theory | |
| dc.subject.keyword | Soft Spheres | |
| dc.subject.keyword | Hyperspheres | |
| dc.subject.keyword | Fluid | |
| dc.subject.ucm | Termodinámica | |
| dc.subject.unesco | 2213 Termodinámica | |
| dc.title | Hard-sphere and hard-disk freezing from the differential formulation of the generalized effective liquid approximation | |
| dc.type | journal article | |
| dc.volume.number | 47 | |
| dcterms.references | [1] P. Tarazona, Mol. Phys. 52, 81 (1984); Phys. Rev. A 31, 2672 (1985). [2] W. A. Curtin and N. W. Ashcroft, Phys. Rev. A 32, 2909 (1985). [3] A. R. Denton and N. W. Ashcroft, Phys. Rev. A 39, 4701 (1989). [4] M. Baus and J. L. Colot, Mol. Phys. 55, 653 (1985). [5] J. F. Lutsko and M. Baus, Phys. Rev. Lett. 64, 761 (1990); Phys. Rev. A 4I, 6647 (1990}. [6] B.B.Laird and D. M. Kroll, Phys. Rev. A 42, 4810 (1990). [7] Y. Rosenfeld, Phys. Rev. A 43, 5424 (1991). [8] J. F. Lutsko and M. Baus, J. Phys. Condens. Matter 3, 6547 (1991). [9] C. F. Tejero, J. F. Lutsko, J. L. Colot, and M. Baus, Phys. Rev. A 46, 3373 (1992). [10] J. A. Cuesta, C. F. Tejero, and M. Baus, Phys. Rev. A 45, 7395 (1992). [11] J. P. Hansen and I. R. McDonald, Theory of Simple Liquids (Academic, London, 1986). [12] M. Baus and J. L. Colot, Phys. Rev. A 36, 3912 (1987). [13] F. Lado, J. Chem. Phys. 49, 3092 (1968). [14] J. J. Erpenbeck and M. Luban, Phys. Rev. A 32, 2920 (1985). [15] H. Xu, Ph. D. thesis, Université Libre de Bruxelles (unpublished). [16] W. A. Curtin and K. Runge, Phys. Rev. A 35, 4755 (1987). [17] W. G. Hoover and F. H. Ree, J. Chem. Phys. 49, 3609 (1968). [18] K. J. Strandburg, Rev. Mod. Phys. 60, 161 (1988). [19] B. J. Adler and T. E. Wainwright, Phys. Rev. 127, 359 (1962); 8. J. Alder, W. G. Hoover, and D. A. Young, J. Chem. Phys. 49, 3688 (1968). [20] J. L. Colot and M. Baus, Phys. Lett. A 119, 135 (1986). [21] X. C. Zeng and D. W. Oxtoby, J. Chem. Phys. 93, 2692 | |
| dspace.entity.type | Publication | |
| relation.isAuthorOfPublication | 45ce99f0-8f7e-41b5-ac11-1ae7ba368c80 | |
| relation.isAuthorOfPublication.latestForDiscovery | 45ce99f0-8f7e-41b5-ac11-1ae7ba368c80 |
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