[Pw_forum] on nosym=.true.
Mahmoud Payami
mpayami at aeoi.org.ir
Wed Nov 24 12:18:59 CET 2010
Dear Gabriele,
I found the origin of the stop:
I must NOT force any coordinates of any atom to remain fix. I just removed " 0 0 0" after the coordinates of the first atom and now it works at the expense that there is a whole translation of the system along the z-direction.
Thank you again for your kind help.
Bests,
mahmoud
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