[Pw_forum] Problem with Wannier function centers

[Konstantin Kudin]

 Hi all,

 It appears that the Wannier code in CP (recent CVS) outputs the
Wannier function centers incorrectly for cells that are specified by
ibrav. The input producing strange centers for a water molecule is
here:
 https://kiev.princeton.edu/failing_example_wannier.j

 With these coordinates:
ATOMIC_POSITIONS angstrom
   O    0.99999987E+00  0.99999761E+00  0.11192157E+01
   H    0.10000039E+01  0.17655545E+01  0.52313723E+00
   H    0.99999715E+00  0.23446441E+00  0.52313869E+00

 wannier centers (fort.26) come out as :
  13.042997  11.149277  10.237439
   1.702475  -0.381710  -1.063049
   1.309338  -0.584178  -0.629999
   2.165164  -0.547665  -1.062867

 This does not make much sense ...

 Kostya

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