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POTCAR

Posted: Tue Nov 17, 2009 9:53 am
by goja25
Hi,
I wanted to ask you where in the PAW POTCAR file I can find information about spin-orbit coupling? Is there any parameter in the POTCAR file which discribes spin-orbit coupling? Please answer.
Thank you.
Margo

POTCAR

Posted: Sat Nov 21, 2009 11:35 pm
by panda

POTCAR

Posted: Thu Nov 26, 2009 1:21 pm
by goja25
Thank you for answer but my question was: where in the POTCAR file is information about s-o coupling?