Hi all,
I am using cp.x(4.3.2) with wannier function.
I can run the simulation with the wannier function. While, when I try to plot
the density of wannier functions, problems happened. I set my calwf = 1, nwf =
1 and wffort = 40.
And then add a card at the end
PLOT_WANNIER
1
while, the output tell me
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
from printout_base_init : error # 43
error in opening unit, check outdir
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
Does anyone know what this problem is? Or, can anyone told me how to use the
plot wannier function? I appreciate it if someone could show me some example to
do that.
Wishes,
Yi
PhD student,
Chemistry Departement, University of North Carolina
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