[Pw_forum] a problem with polarization

Anindya Roy royanin at gmail.com
Wed Jul 9 22:05:59 CEST 2008


Hi Jess,

I'm not sure if your conversion from C -> mC and m^2 -> cm^2 is correct. But
there is still another issue that I'd like to point out:
To best of my knowledge there is some mismatch with the ionic contribution
of polarization between ABINIT and PWscf. Please check (and let us know)  if
the electronic part is the same between both these codes.

Best,
Anindya


PhD student
Rutgers University
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20080709/d8cec6d6/attachment.html>


More information about the users mailing list