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Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
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Finite-difference lattice Boltzmann model with flux limiters for liquid-vapor systems

V Sofonea1, A Lamura, G Gonnella

  • 1Dipartimento di Fisica, Università di Bari, Via Amendola 173, 70126 Bari, Italy. sofonea@acad-tim.tm.edu.ro

Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics
|December 17, 2004
PubMed

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