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Screened Coulombic Orientational Correlations in Dilute Aqueous Electrolytes.
Belloni, Luc; Borgis, Daniel; Levesque, Maximilien.
Afiliación
  • Belloni L; LIONS, NIMBE , CEA, CNRS, Université Paris-Saclay , 91191 Gif-sur-Yvette , France.
  • Borgis D; Maison de la Simulation , USR 3441 CNRS-CEA-Université Paris-Saclay , 91191 Gif-sur-Yvette , France.
  • Levesque M; PASTEUR, Département de chimie, École normale supérieure , PSL University, Sorbonne Université, CNRS , 75005 Paris , France.
J Phys Chem Lett ; 9(8): 1985-1989, 2018 Apr 19.
Article en En | MEDLINE | ID: mdl-29543464
ABSTRACT
The ion-induced long-range orientational order between water molecules recently observed in second harmonic scattering experiments and illustrated with large scale molecular dynamics simulations is quantitatively explained using the Ornstein-Zernike integral equation approach of liquid physics. This general effect, not specific to hydrogen-bonding solvents, is controlled by electroneutrality conditions, dipolar interactions, and dielectric+ionic screening. As expected, all numerical theories recover the well-known analytical expressions established 40 years ago.

Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Idioma: En Revista: J Phys Chem Lett Año: 2018 Tipo del documento: Article País de afiliación: Francia

Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Idioma: En Revista: J Phys Chem Lett Año: 2018 Tipo del documento: Article País de afiliación: Francia
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