Please use this identifier to cite or link to this item: http://hdl.handle.net/2289/3413
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dc.contributor.authorRaghurama, G.-
dc.contributor.authorNarayan, R.-
dc.contributor.authorRamaseshan, S.-
dc.date.accessioned2008-02-05T06:03:45Z-
dc.date.available2008-02-05T06:03:45Z-
dc.date.issued1985-
dc.identifier.citationJournal of Physics C, 1985, Vol.18, p2401-2409en
dc.identifier.issn0022-3719; 0368-3516-
dc.identifier.urihttp://hdl.handle.net/2289/3413-
dc.descriptionRestricted Access.en
dc.description.abstractA semi-empirical model is presented for describing the interionic interactions in molten salts using the experimentally available structure data. An extension of Bertaut's method of non-overlapping charges is used to estimate the electrostatic interaction energy in ionic melts. It is shown, in agreement with earlier computer simulation studies, that this energy increases when an ionic salt melts. The repulsion between ions is described using a compressible ion theory which uses structure-independent parameters. The van der Waals interactions and the thermal free energy are also included in the total energy, which is minimised with respect to isostructural volume variations to calculate the equilibrium density. Detailed results are presented for three molten systems, NaCl, CaCl2 and ZnCl2, and are shown to be in satisfactory agreement with experiments. With reliable structural data now being reported for several other molten salts, the present study gains relevance.en
dc.format.extent542389 bytes-
dc.format.mimetypeapplication/pdf-
dc.language.isoenen
dc.publisherInstitute of Physicsen
dc.relation.urihttp://dx.doi.org/10.1088/0022-3719/18/12/004en
dc.rights1985 The Institute of Physicsen
dc.subjectSoft matteren
dc.subjectLiquids and polymersen
dc.titleA semi-empirical theory of molten saltsen
dc.typeArticleen
Appears in Collections:Research Papers (SCM)

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