[Pw_forum] WAN90_example failed in library mode

lilonghua foursea at 163.com
Fri Aug 12 08:21:25 CEST 2011


Dear all,

The "WAN90_example" is ok in test "stand-alone" mode, but failed in "library mode". Error message is :
 "
  Wannier mode is: library        

  Setting up...

  MP grid is   4 x  4 x  4
  - Number of atoms is (  2)
  - Number of wannier functions is (  0)
 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     from setup_nnkp : error #         1
      wrong excluded band index 
 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     from setup_nnkp : error #         1
..."

I am sure I have compiled pw2wannier90.x with -D__WANLIB and libwannier.a.
How can I solve this proplem?

2011-08-12 



lilonghua 
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