[Wannier] hi, I would like to ask how to generate *.xsf file? Thanks a lot.

[r95222066 at ntu.edu.tw]

   hi, I 'm doing Batio3 as an example. Thanks for Mr.Jonathan answers before.
  I can run the whole wannier90 procedure. But today when I want to  
use wannier90.x to generate Batio3.xsf file like example1 (gaas). I  
got a question.
Here is my process:
------------------------------------------------------------------------------
process: My Batio3.win has set wannier_plot=true. Then run wannier90.x Batio3
------------------------------------------------------------------------------
but Batio3.xsf flie does not exist.
    So I take only copper.scf;copper.nscf;copper.pw2wan;copper.win  
files in example 6 as a test. I run example 6 as the steps as follow
   pw.x < copper.scf  > scf.out
   pw.x < copper.nscf > nscf.out
   wannier90.x -pp copper
   pw2wannier90.x < copper.pw2wan > pw2wan.out (this write mnn,amn,eig files)
   wannier90.x copper
, I found the output files have no copper.xsf.

The other question is I got Batio3.bxsf file,but when I use xcrysden  
to open the file . I have a error message. Is the top of some lines in  
Batio3.bxsf file like
------------------------------------------------------------------------------
   BEGIN_INFO
        #
        # this is a Band-XCRYSDEN-Structure-File
        # for Fermi Surface Visualisation
        #
        # Generated by the Wannier90 code http://www.wannier.org
        # On 20Jul2007 at 20:23:28
        #
        Fermi Energy:   0.0000000000000000
   END_INFO

----------------------------------------------------------------------------
must delete ?  Because when I use xcrysden to open example1 gaas.xsf  
filem, i must delete the top of lines which have # sign in gaas.xsf  
file.

regards
Bing-Hong Chen