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Semi-infinite boundary conditions for the simulation of interfaces: the Ar/CO2(s) model revisited

Rocio de Gregorio1, Jorge Benet, Nebil A Katcho

  • 1Departamento de Química Física, Facultad de Ciencias Químicas, Universidad Complutense, Madrid 28040, Spain.

The Journal of Chemical Physics
|March 20, 2012
PubMed

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