310 citations · 310 across the 2 of their papers we have counts for
2 papers
cond-mat.soft2020
Using Molecular Simulation to Compute Transport Coefficients of Molecular Gases
Xipeng Wang, Simón Ramírez-Hinestrosa, Daan Frenkel
The existing kinetic theory of gases is based on an analytical approach that becomes intractable for all but the simplest molecules. Here we propose a simple numerical scheme to co…
cond-mat.stat-mech2019★ 310 cited
The Lennard-Jones potential: when (not) to use it
Xipeng Wang, Simòn Ramírez-Hinestrosa, Jure Dobnikar +1
The Lennard-Jones 12-6 potential (LJ) is arguably the most widely used pair potential in Molecular Simulations. In fact, it is so popular that the question is rarely asked whether…