structure file of pmma

Matt W mattwa... at
Wed May 9 17:54:58 UTC 2018


really this forum can only help with specifics of running CP2K.  Finding a 
structure file isn't really something we can help with.

There are quite a number of resources now at 
and, which should help in setting up a 
general calculation using CP2K. 

Once you narrow down the question we are happy to help, but there is no way 
of answering such a general question on an internet forum.


On Wednesday, May 9, 2018 at 12:15:22 PM UTC+1, Vikas Sharma wrote:
> Dear all,
> I am searching for an structure file to simulate the pmma for the academic 
> project point of view.
> Kindly, help me to create the input file for the cp2k project including 
> the details of structural input parameters.
> thanks in advance,
> -- 
> Dr. Vikas Sharma
> ----------------------------------
> Assistant Professor & Head, Department of Physics,
> School of Physical Sciences,
> Doon University, Dehradun 248001,
> Uttarakhand, India.
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