[Wien] LDA+U and external magnetic field

2016-10-17 Thread Avijeet Ray
> > Dear Wien2k community and Prof. Blaha, > > I am trying to do a calculation using both LDA+U and external magnetic > field simultaneously. I have seen previous emails regarding this. There is > an old email where it is suggested how to implement both LDA+U and > external magnetic field. >

[Wien] LDA+U and external magnetic field

2015-07-31 Thread Bin Shao
Dear all, I intend to calculated the split of f-band in the external magnetic field. Normally, the Hubbard U should be applied to the f-orbital. So how to achieve LDA+U and the external magnetic field in a single scf calculation? Best, Bin -- Bin Shao Postdoc Department of Physics, Tsinghua