[DFTB-Plus-User] waveplot
n.salami at srbiau.ac.ir
n.salami at srbiau.ac.ir
Sat Mar 8 06:49:05 CET 2014
Dear dftb+ users,
Good time,
I want to know which orbitals carry the current after running by
DFTB+NEGF.
I thought that I can plot the charge density with waveplot, but when I
wrote "WriteEigenvectors" and "WritedetailedXML" in dftb_in.hsd.device
after "WriteTunneling", I have faced to an error.
Could you help me about this, Please?
Thanks in advance,
Kind Regards.
Nadia
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