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Hierarchy of the Collective Effects in Water Clusters
1Institute of Organic Chemistry, Research Centre for Natural Sciences, Hungarian Academy of Sciences , P.O. Box 286, Budapest, 1051 Hungary.
The Journal of Physical Chemistry. A
|January 16, 2016
Abstract:
The results of dipole moment as well as of intra- and intermolecular bond order calculations indicate the big importance of collective electrostatic effects caused by the nonimmediate environment in liquid water models. It is also discussed how these collective effects are built up as consequences of the electrostatic and quantum chemical interactions in water clusters.
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