[gmx-users] shear viscosity

2013-11-13 Thread Ahmet yıldırım
Dear users, g_energy -f *.edr -vis I have two questions about the results of eviscoi.xvg ( derivative of Einstein relation): 1.) I dont understand the unit of y-axis. It is kg.m^(-1).s^(-1).10^(-3) in B.Hess 2002 In eviscoi.xvg @yaxis label (kg m\S-1\N s\S-1\N ps) That is The unit of

[gmx-users] Shear viscosity

2009-10-30 Thread Vitaly V. Chaban
Hi all, I am trying to master the art of shear viscosity calculation using g_energy -vis. Plotting the first column in visco.xvg over time, the nearly straight line is obtained. Is it OK? How can one get the viscosity value from these data? My simulation details for this task are: NVT, 298K,