[Wien] Reg: Will -qtl will work along with -so and -orb

[Gavin Abo]

I suggest the readings:

https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg17735.html
https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg18243.html
https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg16889.html


On 3/18/2019 9:32 PM, Peram sreenivasa reddy wrote:
> Dear Wien2k,
>
> I am trying to get the DOS for a system which i included -so and -orb.
> My scf calculation successfully completed with "runsp_lapw -so -orb 
> -ec 0.000001 -p".
>
> I tried "x lapw2 -qtl -so -orb -up -p". It is ended with an error
>  "ERROR: -qtl and -orb switches are not compatible
> Unmatched '.
> "
> After this i checked "x -h lapw2" as it is showing bellow.
> x lapw2 [-c -up/-dn -p -so -orb -qtl -alm -almd -qdmft -fermi -efg -hf 
> -redklist -band -eece -vresp -in1orig -help_files -emin X -all X Y 
> -scratch dir ]
>
> It indicates lapw2 will allow -qtl, -so and -orb. Is it correct?
>
> Thank you very much in advance.
>
> Thanking you.
>
>
>
>
>
>
> -- 
> /P.V.SREENIVASA REDDY/
> /Post Doctoral Research Fellow/
> /Department of Physics, /
> /Physics Building 2,/
> /NCKU, Tainan, Taiwan/
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