[Pw_forum] projwfc.x error
Zhiting Tian
zhiting at MIT.EDU
Thu Sep 29 05:04:55 CEST 2011
Dear all,
I searched on forum but didn't see this error. I got the error message as following:
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
from d_matrix_so : error # 19
D_S (j=1/2) for this symmetry operation is not unitary
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
My in_pdos is:
&inputpp
prefix='PbSedos',
outdir='/home/.../tmp'
Emin=-10,Emax=15,DeltaE=0.1
/
Does anyone know how to solve it?
Thanks a lot.
Zhiting Tian
Department of Mechanical Engineering
Massachusetts Institute of Technology
Cambridge, MA 02139
More information about the users
mailing list