No, at the moment I do not have plans to implement that.
If I check their NiO-DOS, I'd claim it is still wrong, because from XES
spectra the O-p states should be BELOW the Ni-d, which is not the case
in DFT+U (+...)
On 03/24/2016 02:51 PM, Osama Yassin wrote:
Dear Prof Blaha and wien2k us
Dear Prof Blaha and wien2k users,,
According to Vivaldo Leiria Campo Jr and Matteo Cococcioni the experimental
band gap can be reproduced by using
Extended DFT + *U* + *V* method with on-site and inter-site electronic
interactions
See
http://iopscience.iop.org/article/10.1088/0953-8984/22/5/055
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