[Wien] SCF Convergence with mBJ

[Qasim Mahmood]

Dear User

Could you please let me know what changes we can make to converge our
calculations with mBJ ( at50% doping). I have done almost all the steps
that i know, like to change mixing factor, switch to MSRI from PRATT within
6 to 10 cycles, use dense k-mesh etc.
My system is a magnetic ternary alloy where the magnetic ion is Co.

With many thanks and true regards
















*Mr.Qasim Mahmood*
*Ph.D Schollar, PU,Lahore,Pakistan*
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