[Wien] Spin Orbit
Javad Hashemifar
s_javad at yahoo.com
Wed Mar 24 17:33:17 CET 2004
dear Wien2k Users,
I would like to study the spin orbit correction to my system. Based on UG it
should be done in this way:
1.run[sp]_lapw
2.save_lapw case nrel
3.initso_lapw
4.run[sp]_lapw -so
my question is that last step should be run up to proper convergency or just
one iteration is enough (however DIS jumps!!)
Thanks in advance
Best regards,
Javad Hashemifar
=====
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Javad Hashemifar phone : ++49-30-8413 4804
Permanent : Physics Department, Isfahan University of Technology, Isfahan, Iran
Current : Fritz-Haber-Institut der MPG, Faradayweg 4-6, D-14195 Berlin, Germany
e-mails: hashemi at fhi-berlin.mpg.de & hashemifar at ph.iut.ac.ir
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