The bridge functions of molten salts

The bridge functions of molten NaCl and AgI near melting were obtained by using the model potentials of Born–Huggins–Mayer for NaCl and Vashishta–Rahman for AgI. The calculations of the bridge functions involved molecular dynamics simulations, the extension of the procedure originally proposed by Po...

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Veröffentlicht in:	The Journal of chemical physics 2001-09, Vol.115 (10), p.4676-4680
Hauptverfasser:	Taşseven, Çetin, Enrique González, Luis, Silbert, Moises, Alcaraz, Olga, Trullàs, Joaquim
Format:	Artikel
Sprache:	eng
Schlagworte:	dinàmica molecular Electrolytes Electrolytes Molten salts Molecular dynamics Numerical solutions Electròlits Fused salts Física Molecular dynamics Sals foses Àrees temàtiques de la UPC
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