[gmx-users] question about g_tcaf

[Alif M Latif]

Dear gromacs users and developers,

I have 1 question about the calculation of viscosity using g_tcaf. I got the 
visc_k.xvg file. According to Berk Hess's report, the k values should be 
extrapolated to k=0 to obtain the viscosity. The question is (and I'm sorry if 
this is a silly question), what is "a" in : eta(k) = eta 0 (1-ak^2) ?..can 
someone help? I couldn't find (or missed) it in the paper.

Thank You in advance,

 MUHAMMAD ALIF MOHAMMAD LATIF
Laboratory of Theoretical and Computational Chemistry
Department of Chemistry
Faculty of Science
Universiti Putra Malaysia
43400 UPM Serdang, Selangor
MALAYSIA



      
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