[Pw_forum] QUESTION ABOUT PDOS
maryam salehi
salehi.maryam67 at gmail.com
Fri Feb 1 23:05:10 CET 2013
Hello,
I have a question about running PDOS. When I activate the spin orbit there
is this error message coming up: "D_S (j=1/2)for this symmetry operation
is not unitary". However, it works nicely when there is no spin orbit. I
appreciate if you guide me through this. Thanks.
Regards,
M. Salehi.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20130201/ced901f2/attachment.html>
More information about the users
mailing list