Dear Wien2k users & experts, Is MBJ applicable for half-metal? For some systems, I have obtained half-metallic states with the GGA+U approach & they convert into metal after using MBJ.
Looking forward to your response in this regard., with regards, -- Dr. Shamik Chakrabarti Research Fellow Department of Physics Indian Institute of Technology Patna Bihta-801103 Patna Bihar, India
_______________________________________________ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html