The ABINIT Users Mailing List ( CLOSED )

[Xavier Gonze <gonze@pcpm.ucl.ac.be>]

rabrol@us.ibm.com wrote:
> Hi All,
> Does Abinit include any routines to calculate Wannier functions?
> I am doing a band structure calculation for a molecular crystal
> and want to get Wannier functions for the crystal.
> Thanks,
> Ravi

Dear Ravi,

Unfortunately, not. There were discussion with Nicola Marzari,
two years ago, to interface his code with ABINIT, but nobody
started the work.

Xavier