[Wien] Force convergence within SCF cycle

Oleg Rubel oleg.rubel at Physik.Uni-Marburg.de
Tue Jun 6 13:18:34 CEST 2006


Dear Stefaan,

thank you so much once again.

Oleg Rubel

On Tue, 6 Jun 2006, Stefaan Cottenier wrote:

> No, ~>min -i 100 -s 10 -j 'run_lapw -i 40 -fc 1.0 ', but with TOT
> changed to FOR in the file case.in2(c) *before* you give the 'min' command.



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