Dear Wien2k users
Can we rationalize the cut-off energy of actinide elements to be -4.5 Ry in
running lstart and rkmax as 8.0 in the input file
In case, the DOS does not match even when scf converges, what is the first
change we have to make in the input files?
What are the variables to look f
> Can we rationalize the cut-off energy of actinide elements to be -4.5 Ry in
> running lstart and rkmax as 8.0 in the input file
If there is no message about core-leakage when you run lstart, it is fine.
Are you doing the calculation for the same magnetic/nonmagnetic state as the one
you
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