[Wannier] help

ilhan.yavuz ilhan.yavuz at marmara.edu.tr
Tue Mar 28 14:14:50 CEST 2023


I am getting error message in epw calculation related to Wannierization. 
I included
all phonon calculation wout file with the error and all input files.

The error message is below.


.
.
.
                 l(5) =   2
                 l(6) =   2
      Q(r) pseudized with 0 coefficients

      EPW          :     12.04s CPU     14.20s WALL

      EPW          :     34.32s CPU     36.62s WALL

      -------------------------------------------------------------------
      Wannierization on  6 x  6 x  6 electronic grid
      -------------------------------------------------------------------

      Spin CASE ( default = unpolarized )

      Initializing Wannier90

  kmesh_get: something wrong, found too many nearest neighbours
Error: examine the output/error file for details



-- 
Ilhan Yavuz

Marmara University, Physics Dept.
34722, Kadikoy, Istanbul.
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