[Pw_forum] QE interface to DP code

Stefano Baroni baroni at sissa.it
Fri Oct 28 12:25:44 CEST 2011


what is "the DP code"?
I think that the TDDFT codes distributed with QE are directly interfaced with pw.x
See: http://dx.doi.org/10.1016/j.cpc.2011.04.020
SB

On Oct 28, 2011, at 11:31 AM, Michele Pisarra wrote:

> Hi everyone.
> Is it possible to use the output obtained with Quantum Espresso as an input for the TDDFT code PW?
> I know that the input to the DP code is a *.KSS file. I search through the internet and I found that the post processing code pw2gw should do the job, in it right?
>  However there are no intruction to prepare the input file and run this code in the doc directory.
> Thank you.
> Best Regards,
>  
> Michele Pisarra, PhD Student,
> Dipartimento di Fisica, Università della Calabria
> Via P. Bucci, Cubo 31 C VI piano, 87036, Rende (CS), Italy
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---
Stefano Baroni - SISSA  &  DEMOCRITOS National Simulation Center - Trieste
http://stefano.baroni.me [+39] 040 3787 406 (tel) -528 (fax) / stefanobaroni (skype)

La morale est une logique de l'action comme la logique est une morale de la pensée - Jean Piaget

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