[Pw_forum] vc-relax for a Magnetic atom
physics.skgupta at gmail.com
Wed Nov 23 09:24:42 CET 2011
It is bad habit. This is forum, where you can put input file, so expert can
find the mistake. Another, thing it is good if you provide
your affiliation, so we can know whom i am talking.
My best suggestion, read tutorial and do examples. Really very helpful.
On Wed, Nov 23, 2011 at 1:36 PM, Ali ALLAM <ali.allam2 at hotmail.com> wrote:
> Dear All
> I want to calculate the vc-relax for a magnetic atom, like the manganese
> I try to do it, but always , i obtain errors and the calculation is not
> good at all.
> So what should i add in my input to obtain a better calculation for Mn.
> Can anybody send for me to ali.allam2 at hotmail.com an example for the
> vc-relax for a magnetic atom.
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> Pw_forum at pwscf.org
*Dr. Sanjeev Kumar Gupta*
*Post Doctoral Fellow,
(Ministry of New and Renewable Energy)
Department of Physics,
Bhavnagar University, Bhavnagar-364 022
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