Dear all! Before I run Cp.X, I have set the symmetry of crystal structure. So when I run Cp.X ,is it necessary to set the "ibrav"? If I set the "ibrav", I always get an error. %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% Error in routine ortho (1): ortho went bananas %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
School of Renewable Energy, North China Electric Power University, Beijing, 102206, China
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