Calculating zero-field splitting within VASP
Posted: Mon Apr 02, 2012 9:15 pm
The subject line kind of says it all; I'm looking for a way to calculate zero-field splitting of paramagnetic defect states within VASP.
Is this functionality included in VASP, or are there any external programs which can be used to do this?
Thanks in advance,
Luke
Is this functionality included in VASP, or are there any external programs which can be used to do this?
Thanks in advance,
Luke