[Pw_forum] electronic velocities

[Alaska Subedi]

Dear Nicola,

I was thinking of a way that does not involve wannierization at the moment
(although it would eventually lead to it...).

I just found out that bands.x calculates similar matrix element between the
valence and conduction bands. I will utilize subroutines from that code.

Best,
Alaska

On Jun 17, 2016 10:19 PM, "Marzari Nicola" <nicola.marzari at epfl.ch> wrote:
>
> Sure - Wannier90, EPW, etc...
>
> Sent from a tiny keyboard... Contact info:
> http://theossrv1.epfl.ch/Main/Contact
>
> > On 17 Jun 2016, at 18:27, Alaska Subedi <asubedi at gmail.com> wrote:
> >
> > I'm interested in the electronic velocities because I want to
> > calculate the (anisotropic) transport Eliashberg functions. If anyone
> > has done such calculations using QE, I would appreciate references to
> > such work.
> >
> > Thanks,
> > Alaska
> >
> >
> >
> >> On Fri, Jun 17, 2016 at 8:22 PM, Alaska Subedi <asubedi at gmail.com>
wrote:
> >> Hi all,
> >>
> >> Is there a tool to calculate the electronic velocities [v = (dE/dkx,
> >> dE/dky, dE/kz), where E is the energy]?
> >>
> >> Thanks,
> >> Alaska
> > _______________________________________________
> > Pw_forum mailing list
> > Pw_forum at pwscf.org
> > http://pwscf.org/mailman/listinfo/pw_forum
>
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20160617/e4ac282f/attachment.html>