Density Oscillations in a Nanoscale Water Film on Salt: Insight from Ab lnitio Molecular Dynamics.

The article reports on the molecular dynamics of water film and salt. It mentions that the interaction between water and salt is useful in various fields of study including biology and atmospheric sciences. However, there are difficulties in the study of the native state of salt and its interaction...

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Published in:Journal of the American Chemical Society Vol. 130; no. 27; pp. 8572 - 8574
Main Authors: Limin Liu, Krack, Matthias, Michaelides, Angelos
Format: Article
Published: American Chemical Society 7/9/2008
Subjects:
Online Access:View this record in EBSCOhost
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      dt: 7/9/2008
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      pub: American Chemical Society
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        10.1021/ja8014296
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        atl: Density Oscillations in a Nanoscale Water Film on Salt: Insight from Ab lnitio Molecular Dynamics.
      aug:
        au:
          Limin Liu
          Krack, Matthias
          Michaelides, Angelos
        affil:
          Materials Simulation Laboratory, London Centre for Nanotechnology and Department of Chemistry, University College London, London WC1E 6BT, U.K.
          Fritz-Haber-Institut der Max-Planck-Gesellschaft, Faradayweg 4-6, 14/95 Berlin, Germany
          Paul Scherrer Institut, CH-5232 Villigen-PSI, Switzerland
          Computational Science, Depart~nent of Chemistry and Applied Biosciences, ETH Zurich, USI Campus, Via Giuseppe Buffi 13, CH-6900 Lugano, Switzerland
      su:
        Salt
        Molecular dynamics
        Density functionals
        Water
        Chemistry
      sug:
        subj:
          Salt
          Molecular dynamics
          Density functionals
          Water
          Chemistry
      ab: The article reports on the molecular dynamics of water film and salt. It mentions that the interaction between water and salt is useful in various fields of study including biology and atmospheric sciences. However, there are difficulties in the study of the native state of salt and its interaction with nanoscale water film. The article uses the density functional theory to examine interaction between water and salt.
      pubtype: Academic Journal
      doctype: Article
      src: R
    language: English
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