Exploració per autor "Bitrian Varea, Vicente"

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    • A polarizable ion model for the structure of molten CuI 

      Bitrian Varea, Vicente; Alcaraz Sendra, Olga; Trullàs Simó, Joaquim (2011-01-24)
      Article
      Accés obert
      The results are reported of the molecular dynamics simulations of the coherent static structure factor of molten CuI at 938 K using a polarizable ion model. This model is based on a rigid ion potential to which the many ...

    • Driving mechanisms and streamwise homogeneity in molecular dynamics simulations of nanochannel flows 

      Bitrian Varea, Vicente; Principe, Ricardo Javier (2018-01-12)
      Article
      Accés obert
      In molecular dynamics simulations, nanochannel flows are usually driven by a constant force, that aims to represent a pressure difference between inlet and outlet, and periodic boundary conditions are applied in the ...