Dear users
I am trying to obtain magnetic properties of a compound.But on the cycles, the
charge fluctuate and calculations do not converge or at least converge at many
many cycles. Can this behavior because of DOS. It seems, this compound has a
high DOS at Fermi energy (like sharp peak). Can this sharp high peak cause to
fluctuation of charge in cycles? If it is, what is the solution?
thanks in advanced.
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