Artículo
Re, M.; Laria, D.; Fernández-Prini, R. "Solvent structural contributions to the dissolution process of an apolar solute in water" (1996) Chemical Physics Letters. 250(1):25-30
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Abstract:
We have examined structural features of aqueous microenvironments in the neighborhood of an apolar solute (Xe atom) using molecular dynamics techniques and the simple point charge model to represent the solvent. A detailed comparative study of equilibrium spatial correlations of the solvent structures in bulk and in the neighborhood of the Xe atom was performed. We have also obtained structural information for water surrounding a cavity spontaneously generated in liquid water. Our results indicate the absence of any significant solvent reorientation following the introduction of an apolar solute in a cavity existing in the bulk liquid; this agrees with results from recent neutron scattering experiments.
Registro:
| Documento: | Artículo |
| Título: | Solvent structural contributions to the dissolution process of an apolar solute in water |
| Autor: | Re, M.; Laria, D.; Fernández-Prini, R. |
| Filiación: | Depto. Química de Reactores, Comision Nac. de Energia Atomica, Avenida del Libertador 8250, 1429 Capital Federal, Argentina INQUIMAE, Fac. de Cie. Exactas y Naturales, Universidad de Buenos Aires, Pabellon II, 1428 Capital Federal, Argentina |
| Año: | 1996 |
| Volumen: | 250 |
| Número: | 1 |
| Página de inicio: | 25 |
| Página de fin: | 30 |
| DOI: | http://dx.doi.org/10.1016/0009-2614(95)01449-7 |
| Título revista: | Chemical Physics Letters |
| Título revista abreviado: | Chem. Phys. Lett. |
| ISSN: | 00092614 |
| CODEN: | CHPLB |
| Registro: | https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_00092614_v250_n1_p25_Re |
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Citas:
---------- APA ----------
Re, M., Laria, D. & Fernández-Prini, R. (1996) . Solvent structural contributions to the dissolution process of an apolar solute in water. Chemical Physics Letters, 250(1), 25-30.http://dx.doi.org/10.1016/0009-2614(95)01449-7
---------- CHICAGO ----------
Re, M., Laria, D., Fernández-Prini, R. "Solvent structural contributions to the dissolution process of an apolar solute in water" . Chemical Physics Letters 250, no. 1 (1996) : 25-30.http://dx.doi.org/10.1016/0009-2614(95)01449-7
---------- MLA ----------
Re, M., Laria, D., Fernández-Prini, R. "Solvent structural contributions to the dissolution process of an apolar solute in water" . Chemical Physics Letters, vol. 250, no. 1, 1996, pp. 25-30.http://dx.doi.org/10.1016/0009-2614(95)01449-7
---------- VANCOUVER ----------
Re, M., Laria, D., Fernández-Prini, R. Solvent structural contributions to the dissolution process of an apolar solute in water. Chem. Phys. Lett. 1996;250(1):25-30.http://dx.doi.org/10.1016/0009-2614(95)01449-7
