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A one-dimensional dipole lattice model for water in narrow nanopores

We present a recently developed one-dimensional dipole lattice model that accurately captures the key properties of water in narrow nanopores. For this model, we derive three equivalent representations of the Hamiltonian that together yield a transparent physical picture of the energetics of the wat...

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Detalhes bibliográficos
Main Authors: Köfinger, Jürgen, Hummer, Gerhard, Dellago, Christoph
Formato: Artigo
Idioma:Inglês
Publicado em: American Institute of Physics 2009
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC2832045/
https://ncbi.nlm.nih.gov/pubmed/19388739
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.3106223
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