About: Potential of mean force between ions in infinitely diluted simple short-range models of aqueous electrolytes

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rdf:type	skos:Concept http://linked.opendata.cz/ontology/domain/vavai/Vysledek
Description	As an attempt to assess the effect of the long-range electrostatic interactions in solutions of electrolytes, a simple short-range model (SSM) of electrolytes made up of primitive water and primitive ions (i.e., ions whose Coulombic interaction with water has been replaced by a triangular-well interaction) has been considered to compute the potential of mean force. The sizes of the primitive ions have been set so as to approximate realistic NaCl, Lil, and CsCl electrolytes. It is shown that despite the missing long-range Coulombic interaction the model captures the basic features of real electrolytes while the indirect, i.e. water mediated, potential of mean force in the SSM is in qualitative agreement with that of realistic models. As an attempt to assess the effect of the long-range electrostatic interactions in solutions of electrolytes, a simple short-range model (SSM) of electrolytes made up of primitive water and primitive ions (i.e., ions whose Coulombic interaction with water has been replaced by a triangular-well interaction) has been considered to compute the potential of mean force. The sizes of the primitive ions have been set so as to approximate realistic NaCl, Lil, and CsCl electrolytes. It is shown that despite the missing long-range Coulombic interaction the model captures the basic features of real electrolytes while the indirect, i.e. water mediated, potential of mean force in the SSM is in qualitative agreement with that of realistic models. (en)
Title	Potential of mean force between ions in infinitely diluted simple short-range models of aqueous electrolytes Potential of mean force between ions in infinitely diluted simple short-range models of aqueous electrolytes (en)
skos:prefLabel	Potential of mean force between ions in infinitely diluted simple short-range models of aqueous electrolytes Potential of mean force between ions in infinitely diluted simple short-range models of aqueous electrolytes (en)
skos:notation	RIV/44555601:13440/05:00004832!RIV10-MSM-13440___
http://linked.open...avai/riv/aktivita	S
http://linked.open...avai/riv/aktivity	S
http://linked.open...iv/cisloPeriodika	2
http://linked.open...vai/riv/dodaniDat	2010
http://linked.open...aciTvurceVysledku	Nezbeda, Ivo
http://linked.open.../riv/druhVysledku	J - Článek v odborném periodiku
http://linked.open...iv/duvernostUdaju	S - Úplné a pravdivé údaje nepodléhající ochraně podle zvláštních právních předpisů
http://linked.open...titaPredkladatele	Univerzita Jana Evangelisty Purkyně v Ústí nad Labem / Přírodovědecká fakulta
http://linked.open...dnocenehoVysledku	537238
http://linked.open...ai/riv/idVysledku	RIV/44555601:13440/05:00004832
http://linked.open...riv/jazykVysledku	eng - angličtina
http://linked.open.../riv/klicovaSlova	aqueous electrolytes; simple short-range model of electrolytes; primitive water; primitive ions; potential of mean force (en)
http://linked.open.../riv/klicoveSlovo	aqueous electrolytes primitive ions primitive water simple short-range model of electrolytes potential of mean force
http://linked.open...odStatuVydavatele	UA - Ukrajina
http://linked.open...ontrolniKodProRIV	[AE2AC1068334]
http://linked.open...i/riv/nazevZdroje	Condensed Matter Physics
http://linked.open...in/vavai/riv/obor	BL
http://linked.open...ichTvurcuVysledku	1 (xsd:int)
http://linked.open...cetTvurcuVysledku	2 (xsd:int)
http://linked.open...UplatneniVysledku	2005
http://linked.open...v/svazekPeriodika	8
http://linked.open...iv/tvurceVysledku	Nezbeda, Ivo Vlček, L.
http://linked.open...ain/vavai/riv/wos	000231713000005
issn	1607-324X
number of pages	10 (xsd:int)
http://localhost/t...ganizacniJednotka	13440

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