On the influence of molecular structure on the conductivity of electrolyte solutions - sodium nitrate in water

Autor: H. Krienke
Jazyk: angličtina
Rok vydání: 2013
Předmět:
Zdroj: Condensed Matter Physics, Vol 16, Iss 4, p 43006 (2013)
Druh dokumentu: article
ISSN: 1607-324X
DOI: 10.5488/CMP.16.43006
Popis: Theoretical calculations of the conductivity of sodium nitrate in water are presented and compared with experimental measurements. The method of direct correlation force in the framework of the interionic theory is used for the calculation of transport properties in connection with the associative mean spherical approximation (AMSA). The effective interactions between ions in solutions are derived with the help of Monte Carlo and Molecular Dynamics calculations on the Born-Oppenheimer level. This work is based on earlier theoretical and experimental studies of the structure of concentrated aqueous sodium nitrate solutions.
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