save btw runs?? (Re: [Wien] e-test: subscript out of range)
Steven Homolya
Steven.Homolya at spme.monash.edu.au
Thu Jul 3 15:52:21 CEST 2003
On Thu, 3 Jul 2003, Stefaan Cottenier wrote:
>
> This problem disappears as soon as the 3th iteration is started. Therefore,
> I have by default to run an scf-cycle by
>
> run_lapw -i 1
> run_lapw -i 1
> run_lapw -cc 0.00001 etc.,
>
I'm still not sure about this, but shouldn't one always save_lapw between
run_lapw's?
--
Steven Homolya
School of Physics and Materials Engineering
Monash University, VIC 3800
Australia
Tel: +61 3 9905 3694
Fax: +61 3 9905 3637
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