[DFTB-Plus-User] dftb calculations of magnetic properties

malahmer at umbb.dz malahmer at umbb.dz
Tue May 15 09:10:51 CEST 2012


Dear all dftb user's
i have tried to run calculations on magnetic peoperties of ZnO doped C supercell. i have tried to use initial spins command but this don't work. the code always print a message error and stop.
the code ask to define the spin parameters and consatants  for the Zn O and C atoms
however i don't know where i can find these parameters so i would ask if any one have an idea on this problem
best regards


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