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Convergence of Kirkwood–Buff Integrals of Ideal and Nonideal Aqueous Solutions Using Molecular Dynamics Simulations

Milzetti, Jasmin and Nayar, Divya and van der Vegt, Nico F. A. (2018):
Convergence of Kirkwood–Buff Integrals of Ideal and Nonideal Aqueous Solutions Using Molecular Dynamics Simulations.
In: The Journal of Physical Chemistry B, pp. 5515-5526, 122, (21), ISSN 1520-6106,
DOI: 10.1021/acs.jpcb.7b11831,
[Online-Edition: https://doi.org/10.1021/acs.jpcb.7b11831],
[Article]

Item Type: Article
Erschienen: 2018
Creators: Milzetti, Jasmin and Nayar, Divya and van der Vegt, Nico F. A.
Title: Convergence of Kirkwood–Buff Integrals of Ideal and Nonideal Aqueous Solutions Using Molecular Dynamics Simulations
Language: German
Journal or Publication Title: The Journal of Physical Chemistry B
Volume: 122
Number: 21
Divisions: DFG-Collaborative Research Centres (incl. Transregio)
DFG-Collaborative Research Centres (incl. Transregio) > Collaborative Research Centres
DFG-Collaborative Research Centres (incl. Transregio) > Collaborative Research Centres > CRC 1194: Interaction between Transport and Wetting Processes
DFG-Collaborative Research Centres (incl. Transregio) > Collaborative Research Centres > CRC 1194: Interaction between Transport and Wetting Processes > Research Area B: Modeling and Simulation
DFG-Collaborative Research Centres (incl. Transregio) > Collaborative Research Centres > CRC 1194: Interaction between Transport and Wetting Processes > Research Area B: Modeling and Simulation > B05: Molecular Modelling of Complex Liquids at the Three-phase Contact Line
Profile Areas
Profile Areas > Thermo-Fluids & Interfaces
07 Department of Chemistry
07 Department of Chemistry > Computational Physical Chemistry
Date Deposited: 04 Jul 2018 08:49
DOI: 10.1021/acs.jpcb.7b11831
Official URL: https://doi.org/10.1021/acs.jpcb.7b11831
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