[Pw_forum] pw.x
Bramha Pandey
pandey.bramha at gmail.com
Thu Sep 20 11:58:10 CEST 2012
Could you please give your affiliation before posting in this forum.???
Without your input file no one can exactly estimate what is going wrong in
your system.
On Thu, Sep 20, 2012 at 3:15 PM, Sakhrawi Taoufek <tsakhrawi at yahoo.com>wrote:
> I made a pw.x calculation for the compound FeRh to estimate the value
> of a, the problem is that I always find a value that doubles the expected
> value
> Do you have any idea what to do
> thank you
>
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://www.democritos.it/mailman/listinfo/pw_forum
>
>
--
Thanks and Regards
Bramha Prasad Pandey
Ph.D Student Indian School of Mines(ISM)
Dhanbad, INDIA.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20120920/10f63e11/attachment.html>
More information about the users
mailing list