Oh wow I haven't seen that one before! Thanks!
Chris
On Tue, Aug 27, 2019, 7:34 PM Nicola Marzari wrote:
>
>
> Very cool work ~10 years ago by Wei Cai and Giulia Galli (PRL) - but I
> think it's not available anywhere.
>
> nicola
>
>
>
> On 27/08/2019 19:29, Christoph Wo
Very cool work ~10 years ago by Wei Cai and Giulia Galli (PRL) - but I
think it's not available anywhere.
nicola
On 27/08/2019 19:29, Christoph Wolf wrote:
As far as I know magnetic fields are incompatible with periodic boundary
conditions and plane-wave DFT. I di
As far as I know magnetic fields are incompatible with periodic boundary
conditions and plane-wave DFT. I did find however several implementations
based on LAPW where the magnetic field is applied in the muffin tin only -
check out the ELK code for example, it is free.
HTH!
Chris
--
Postdoctoral
