[gmx-users] Re[5]: g_msd vs g_velacc. [SOLVED]

Vitaly Chaban vvchaban at gmail.com
Tue Jun 17 14:31:45 CEST 2008

> I thought the flag -mol
> calculates
> the momentum autocorrelation function, so in my opinion the result has
> to be divided
> by the square of the masses of the molecules to obtain the diffusion
> constant.

Flo, you're completely right. Sorry for my mistake as for
normalization here.


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