[Pw_forum] Density of states
Sanjeev Gupta
physics.skgupta at gmail.com
Sun Sep 16 17:17:24 CEST 2012
Yes, no further change is required.
best
skg
On Sun, Sep 16, 2012 at 8:15 AM, Sohail Ahmad <sohailphysics at yahoo.co.in>wrote:
>
> Dear QE Users
>
> I am trying to find DOS for MoS using version 5.0.1
>
> I have already done this using version 4.2.1 around one month back
>
> The only difference i noticed that i have to use &dos instead of &inputpp
> and rest others i believe it should be same
>
> Can anyone help me in this regard ??
>
> Input file is attached
>
> &dos
> outdir = './OUT'
> prefix = 'MoS'
> Emin = -7.00, Emax = 13.00
> DeltaE = 0.001,
> fildos = 'MoS.dos.dat'
>
> ---------------------------------------------------------------------
>
> *Sohail Ahmad*
>
> Assistant Professor
>
> Department of Physics
>
> King Khalid University
>
> Abha, Saudi Arabia
>
>
>
> Contact: +966 (0) 556776986 (M)
> --------------------------------------------------------------------
>
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://www.democritos.it/mailman/listinfo/pw_forum
>
>
--
*Dr. Sanjeev Kumar Gupta*
*Post Doctoral Fellow,
(Ministry of New and Renewable Energy)
Department of Physics,
Bhavnagar University, Bhavnagar-364 022
Gujarat, India*
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20120916/e341208e/attachment.html>
More information about the users
mailing list