[Pw_forum] similar to WAVECAR and CHGCAR in VASP

[Paolo Giannozzi]

Yes and no. PWscf produces various files containing general data, charge
density, wavefunctions. It can read those files, but with many limitations.
For instance, it is not possible to perform a calculation at higher cutoff
starting from data produced at lower cutoff

Paolo

On Mon, Aug 3, 2015 at 9:29 PM, Amir <amir_ni21 at yahoo.com> wrote:

> When we run a calculation in VASP, it makes WAVECAR and CHGCAR files that
> can be used as input file for further calculations, for example, if we want
> to increase the number of k points or increase the cut off energy. It is
> also very useful, especially, if you want to continue a relaxation without
> doing the first loop of self-consistent calculation since we already have
> the charge density for the initial structure. Is there such thing in QE?
>
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
>



-- 
Paolo Giannozzi, Dept. Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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