[gmx-users] appropriate values fot tau_t and tau_p

Dear all, I'm trying to receive thermal properties of a LJ liquid by performing a NPT simulation. To ensure the simulation is in the canonic ensemble, I've chosen the Nose-Hoover thermostat and the Parrinello-Rahmann barostat. I performed several runs with different values for tau_t and tau_p.

RE: [gmx-users] appropriate values fot tau_t and tau_p

oscillations by couplings between the thermo and barostat. Berk From: rolf.is...@rwth-aachen.de To: gmx-users@gromacs.org Date: Fri, 24 Jul 2009 10:51:16 +0200 Subject: [gmx-users] appropriate values fot tau_t and tau_p Dear all, I'm trying to receive thermal properties of a LJ liquid