336 citations · 1.6k across the 14 of their papers we have counts for
Showing 2012 · cond-mat.softShow all
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cond-mat.soft2012★ 46 cited
Free energy calculations for atomic solids through the Einstein crystal/molecule methodology using GROMACS and LAMMPS
J. L. Aragones, C. Valeriani, C. Vega
In this work the free energy of solid phases is computed for the Lennard-Jones potential and for a model of NaCl. The free energy is evaluated through the Einstein crystal/molecule…
cond-mat.soft2012★ 29 cited
From compact to fractal crystalline clusters in concentrated systems of monodisperse hard spheres
Chantal Valeriani, Eduardo Sanz, Peter N. Pusey +3
We address the crystallization of monodisperse hard spheres in terms of the properties of finite- size crystalline clusters. By means of large scale event-driven Molecular Dynamics…