[Wien] LDA+U & External Field
Sherif Yehia
wien542002 at yahoo.com
Sat Oct 11 00:23:34 CEST 2003
Hello All,
I am working on calculating Magnetic Anisotropy
Energy MAE in SmCo5 I hope to see effect of external
magnetic field.
I would like to ask if the WIEN2k code allow for
LDA+U and an external field to be applied
simultaneously.
In the case.inorb file has a switch which can either
call orbital polarization, LDA+U, or an external
magnetic field.(I hope there is another switch to
include both)
In case Wien2k does not do that I would welcome all
comments ,advice and precaution to develop better
understanding about the reason of not including both
effects.
Thanks all for efforts and time
Sherif Yehia
Physics Dept
Helwan Univ.
Cairo Egypt
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