[Wien] polarisation of non magnetic compounds

Wien2k User wien2k.user at gmail.com
Sat Dec 28 01:06:56 CET 2019


dear dr.  Oleg  ;

Thank you for your answer
I have another question

using BerryPI, I have read that we cannot study the spontaneous
polarizations for metals, I want to know why?


thank you in advance

Le ven. 27 déc. 2019 à 23:07, Rubel, Oleg <rubelo at mcmaster.ca> a écrit :

> Any non-centrosymmetric material with a band gap should have some
> polarization.
>
> Oleg
>
> On Dec 27, 2019, at 09:27, Wien2k User <wien2k.user at gmail.com> wrote:
>
> Dear Wien2k users;
>
> how can we know if a non-magnetic material is polarized or not? or we have
> only to calculate its polarization (BerryPI) .
>
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
> SEARCH the MAILING-LIST at:
> http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
>
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
> SEARCH the MAILING-LIST at:
> http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
>
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20191228/d7bd2dff/attachment.html>


More information about the Wien mailing list