LAMMPS WWW Site - LAMMPS Documentation - LAMMPS Mailing List Archives
Re: [lammps-users] Pressure components increase during Minimization
[Date Prev][Date Next][Thread Prev][Thread Next][Date Index][Thread Index]

Re: [lammps-users] Pressure components increase during Minimization


From: Axel Kohlmeyer <akohlmey@...24...>
Date: Mon, 7 May 2018 15:14:39 -0400

On Mon, May 7, 2018 at 12:36 PM, Khourshaei Shar, Ali
<akhoursh@...6666...> wrote:
> Dear LAMMPS users,
>
> Hi,
>
>
> For my simulation I observe that the value of  pressure components, i.e. Pxx
> Pyy Pzz, increases during the minimization as follow. But, I don't think it
> is logical. Do you have any explanation or comment please ?

it is impossible to say anything meaningful without knowing more
details. i can imagine scenarios where this could happen.

axel.

>
>
> Initial:
>
> 528.75226    725.54093     2592.256
>
> Final:
>
> -133206.05    -133167.2        32287
>
> Thanks in advance,
>
> Ali
>
>
>
> ------------------------------------------------------------------------------
> Check out the vibrant tech community on one of the world's most
> engaging tech sites, Slashdot.org! http://sdm.link/slashdot
> _______________________________________________
> lammps-users mailing list
> lammps-users@lists.sourceforge.net
> https://lists.sourceforge.net/lists/listinfo/lammps-users
>



-- 
Dr. Axel Kohlmeyer  akohlmey@...24...  http://goo.gl/1wk0
College of Science & Technology, Temple University, Philadelphia PA, USA
International Centre for Theoretical Physics, Trieste. Italy.