[Pw_forum] q-point for Negative Bravais Lattice (-12) for lambda.x execution

[Isaiah Moses]

Beautiful!
Thanks so much Prof. Paolo.
I now have my special q-points for ibrav = -12.

I appreciate your time.

Isaiah

On Thu, Jun 22, 2017 at 6:20 PM, Paolo Giannozzi <p.giannozzi at gmail.com>
wrote:

> "make pw"
>
> On Thu, Jun 22, 2017 at 6:36 PM, Isaiah Moses <imoses87 at gmail.com> wrote:
> > I have succeeded in modifying the PW/tools/kpoints.f90 file but the
> quantum
> > espresso still makes use of the previous version of the file.
> >
> > Can you please assist in letting me know how I can update the program so
> the
> > modified version is ran?
> >
> > I shall be greatly delighted to receive such help.
> >
> > Thanks a lot,
> > Isaiah
> >
> > On Thu, Jun 22, 2017 at 2:50 PM, Isaiah Moses <imoses87 at gmail.com>
> wrote:
> >>
> >> Thanks once again Paolo,
> >> But unfortunately, it didn't work for the negative ibrav,
> >>
> >> I appreciate your assistance.
> >> Isaiah
> >>
> >> On 6/22/17, Isaiah Moses <imoses87 at gmail.com> wrote:
> >> > Great!
> >> > Thanks a lot Paolo.
> >> > I really appreciate your kind gesture.
> >> > Isaiah
> >> >
> >> > On 6/22/17, Paolo Giannozzi <p.giannozzi at gmail.com> wrote:
> >> >> On Thu, Jun 22, 2017 at 11:52 AM, Isaiah Moses <imoses87 at gmail.com>
> >> >> wrote:
> >> >>
> >> >>> I don't have experience in fortran coding.
> >> >>
> >> >> it's time to get some.
> >> >>
> >> >> Anyway: the attached version should work for any allowed value of
> >> >> ibrav (no warranty)
> >> >>
> >> >> Paolo
> >> >>
> >> >> --
> >> >> Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
> >> >> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
> >> >> Phone +39-0432-558216, fax +39-0432-558222
> >> >>
> >> >
> >> >
> >> > --
> >> > Isaiah Abu Moses
> >> > Graduate Student,
> >> > Physics Department,
> >> > University of Ibadan,
> >> > Nigeria
> >> >
> >>
> >>
> >> --
> >> Isaiah Abu Moses
> >> Graduate Student,
> >> Physics Department,
> >> University of Ibadan,
> >> Nigeria
> >
> >
> >
> >
> > --
> > Isaiah Abu Moses
> > Graduate Student,
> > Physics Department,
> > University of Ibadan,
> > Nigeria
> >
> > _______________________________________________
> > Pw_forum mailing list
> > Pw_forum at pwscf.org
> > http://pwscf.org/mailman/listinfo/pw_forum
>
>
>
> --
> Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
> Phone +39-0432-558216, fax +39-0432-558222
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
>



-- 
Isaiah Abu Moses
Graduate Student,
Physics Department,
University of Ibadan,
Nigeria
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