[Q-e-developers] GIPAW and QE compilation

Paolo Giannozzi paolo.giannozzi at uniud.it
Thu Oct 22 08:18:55 CEST 2015


Dear Francisco

I don't know much about the current status of GIPAW. I am forwarding your
query to the q-e-developers mailing list. Best regards

Paolo

On Thu, Oct 22, 2015 at 1:33 AM, Francisco Martinez <fmartinm at mit.edu>
wrote:

> Dear Prof. Giannozzi,
>
> I am a postdoctoral researcher at MIT in the research group of Prof.
> Markus Buehler. I work on DFT and I am trying to run GIPAW for NMR
> calculations. I have been attempting to compile GIPAW 5.1 with QE 5.0.2. I
> tried first QE 5.2.1 but it looks that GIPAW is for an older version. I
> also tried to compile with the 10590 version of QE 5.2.1. None of these
> work.
>
> Because you are one of the developers of the code, could you please give
> me some advice about how to proceed? What are the correct version and where
> to download them?
>
> Thank you very much in advance
>
> Francisco
>
>
>
> --
> Dr. Francisco Martin-Martinez
> Laboratory for Atomistic & Molecular Mechanics
> Department of Civil and Environmental Engineering
> Massachusetts Institute of Technology
> Cambridge, MA 02139-4307, USA
> Room 1-174 | Phone: +1 617 258 8070 | Mobile: +1 857 500 9201
> URL: http://web.mit.edu/fmartinm/www/
> e-mail: fmartinm at mit.edu
>
>


-- 
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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