[Wannier] about non-collinear and spin-orbital calculation

chen ian 86ianchen at gmail.com
Sat Jun 15 03:50:32 CEST 2013


dear all

I've been trying to calculate and plot Wannier functions of a system which
includes
non-collinear and spin-orbital calculation. But after pw2wannier90 ,the
program shows an error message like this,


 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     Error in routine pw2wannier90 (1):

     write_unk not implemented with ncls
 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%


does this means for non-collinear and spin-orbital calculation, it's not
possible to plot wannier function in the present version of wannier90?

thank you
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