Dear experts,
I want to calculate x photons as described below:
first run scf calculation, then a nscf calculation, then a ph.x run for a while
and then stopped.
the output is below:
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
Error in routine set_irr_sym_new (5722):
wrong representation
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
stopping ...
what should I do?
thank you in advance,
Abdullah
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