Be careful and check if your calculations with PRATT 0.05 are really
converged and check :ENE AND :DIS
With small PRATT mixing some pseudo-convergence can happen and in
general I'd recommend PRATT mixing only for nasty cases and a couple of
steps, before switching back to MSR1.
Am
In general, the total energies that are compared need to be obtained
with the same setting. So, all the total energies have to be obtained
with either TETRA or TEMP.
You can try to restart with TETRA the calculation that you converged
with TEMP (clean_lapw should not be executed after the
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