[Wien] Asking again ~(-_-)~ ORB calculation error

Stefaan Cottenier Stefaan.Cottenier at fys.kuleuven.ac.be
Mon Aug 11 20:12:48 CEST 2003


> Regarding to Stefan's comments:
> First I run "runsp_lapw -i 2", and then with *.inorb 
> and *.indmc have been prepared, I run
>              x lapwdm -up -c
>              x lapwdm -dn -c
> (these two executions give me *dmatup and *dmatdn),
>  after that there are not any errors when I run
>              x -orb -up -c
>              x -orb -dn -c
> But the trouble happends  when I use "runsp_lapw -orb"

Be careful not to mess up the options. Use the same ones you see in your 
dayfile: 'x lapwdm -up -c -so' and 'x orb -up' (in the latter: not -orb but 
orb !) So, same question: does it give screen output with errors now?

Stefaan




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