2017 Annual Meeting

Computing Shear Viscosity Using Green-Kubo and Reverse Non-equilibrium Molecular Dynamics: Best Practices and Caveats

Authors

Edward J. Maginn - Presenter, University of Notre Dame
Yong Zhang, University of Notre Dame


Abstract: Computing Shear Viscosity Using Green-Kubo and Reverse Non-equilibrium Molecular Dynamics: Best Practices and Caveats (2017 AIChE Annual Meeting)