Dear, Y. M. Qian. Data in wannier_bands.dat are eigenvalues of Hamiltonian in Wannier functions basis. I suppose that it is definetly what you need. There are no special parameters that control the output. You are only able to generate or not to generate wannier_bands.dat during Hamiltonian matrix construction.
Anyway, there are special example of wannier_ham.x run in standart QE examples. You are welcome to ask if you have any questions. 2010/11/10 yumin qian <yuminqian at gmail.com>: > Dear PWscf user > ???? I want to get the band dispersion information using wannier orbital, I > find?the file? wannier_ham.f90?the output?date?can be written > in?wannier_band.dat > ???? is?anybody? know what data is?meaning??Are they the?same with > conventional band dispersion curve ?? which parameter control the output > data? > > -- > Sincerely Y. M. Qian > Laboratory of Condensed Matter Theory and Materials Computation > Institute of Physics(IOP), Chinese Academy of Sciences(CAS) > Tel:? + 8610 8264 9147 > E-Mail:yuminqian at gmail.com > P.O.Box 603?? Beijing 100190 > China > > > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://www.democritos.it/mailman/listinfo/pw_forum > > -- Best regards, Dmitry Korotin Institute of Metal Physics S. Kovalevskaya, 18 620041 Ekaterinburg GSP-170 Russia
