On the influence of molecular structure on the conductivity of electrolyte solutions - sodium nitrate in water
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 m...
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Format: | Article |
Language: | English |
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Institute for Condensed Matter Physics
2013-01-01
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Series: | Condensed Matter Physics |
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Online Access: | http://dx.doi.org/10.5488/CMP.16.43006 |
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author | H. Krienke |
author_facet | H. Krienke |
author_sort | H. Krienke |
collection | DOAJ |
description | 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. |
first_indexed | 2024-12-16T16:23:46Z |
format | Article |
id | doaj.art-e4f18e6aa06a434cabd6cb1040088822 |
institution | Directory Open Access Journal |
issn | 1607-324X |
language | English |
last_indexed | 2024-12-16T16:23:46Z |
publishDate | 2013-01-01 |
publisher | Institute for Condensed Matter Physics |
record_format | Article |
series | Condensed Matter Physics |
spelling | doaj.art-e4f18e6aa06a434cabd6cb10400888222022-12-21T22:24:51ZengInstitute for Condensed Matter PhysicsCondensed Matter Physics1607-324X2013-01-011644300610.5488/CMP.16.43006On the influence of molecular structure on the conductivity of electrolyte solutions - sodium nitrate in waterH. KrienkeTheoretical 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.http://dx.doi.org/10.5488/CMP.16.43006electrolytesaqueous sodium nitratestructural and transport propertiesconductance |
spellingShingle | H. Krienke On the influence of molecular structure on the conductivity of electrolyte solutions - sodium nitrate in water Condensed Matter Physics electrolytes aqueous sodium nitrate structural and transport properties conductance |
title | On the influence of molecular structure on the conductivity of electrolyte solutions - sodium nitrate in water |
title_full | On the influence of molecular structure on the conductivity of electrolyte solutions - sodium nitrate in water |
title_fullStr | On the influence of molecular structure on the conductivity of electrolyte solutions - sodium nitrate in water |
title_full_unstemmed | On the influence of molecular structure on the conductivity of electrolyte solutions - sodium nitrate in water |
title_short | On the influence of molecular structure on the conductivity of electrolyte solutions - sodium nitrate in water |
title_sort | on the influence of molecular structure on the conductivity of electrolyte solutions sodium nitrate in water |
topic | electrolytes aqueous sodium nitrate structural and transport properties conductance |
url | http://dx.doi.org/10.5488/CMP.16.43006 |
work_keys_str_mv | AT hkrienke ontheinfluenceofmolecularstructureontheconductivityofelectrolytesolutionssodiumnitrateinwater |