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Vrbka, Luboš ; Lund, Mikael ; Kalcher, Immanuel ; Dzubiella, Joachim ; Netz, Roland R. ; Kunz, Werner

Ion-specific thermodynamics of multicomponent electrolytes: A hybrid HNC/MD approach

Vrbka, Luboš, Lund, Mikael , Kalcher, Immanuel, Dzubiella, Joachim, Netz, Roland R. and Kunz, Werner (2009) Ion-specific thermodynamics of multicomponent electrolytes: A hybrid HNC/MD approach. The Journal of Chemical Physics 131 (15).

Date of publication of this fulltext: 19 Dec 2024 12:00
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Item typeArticle
Journal or Publication TitleThe Journal of Chemical Physics
Publisher:AMER INST PHYSICS
Place of Publication:MELVILLE
Volume:131
Number of Issue or Book Chapter:15
Date2009
InstitutionsChemistry and Pharmacy > Institut für Physikalische und Theoretische Chemie > Chair of Chemistry VI - Physical Chemistry (Solution Chemistry) > Prof. Dr. Werner Kunz
Identification Number
ValueType
10.1063/1.3248218DOI
KeywordsMCMILLAN-MAYER CONVERSION; MONTE-CARLO SIMULATIONS; MEAN SPHERICAL MODEL; MSA-NRTL MODEL; MOLECULAR-DYNAMICS; AQUEOUS-SOLUTIONS; ACTIVITY-COEFFICIENTS; DIELECTRIC-PROPERTIES; INTEGRAL-EQUATION; ELEVATED-TEMPERATURES;
Dewey Decimal Classification500 Science > 540 Chemistry & allied sciences
StatusPublished
RefereedYes, this version has been refereed
Created at the University of RegensburgYes
Item ID66837

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