[Wien] lapw0.def failed

[Laurence Marks]

Now you have provided enough information. The information is in what you
sent:

/home/hmd/wien2k23/lapw0: Command not found

That means exactly what it says, it could not find or execute that file.
Most likely one of:

   - lapw0 is not in that directory (try ls /home/hmd/wien2k23/)
   - You did not export the PATH (do echo $PATH) and/or you have WIENROOT
   wrong
   - You don't have read rights to that file (try ls -l
   /home/hmd/wien2k23/)



On Thu, Jul 20, 2023 at 4:46 PM Brik Hamida <hmd.brik at gmail.com> wrote:

> Dear
> *) For initialisation :
>
> Init_lapw finished ok !
> hmd at hmd-host:~/WIEN2k/MoS2monolayer$ cat *.in0
> TOT  XC_PBE     (XC_LDA,XC_PBESOL,XC_WC,XC_MBJ,XC_SCAN)
> NR2V      IFFT      (R2V)
>    32   32  300    2.00  1 NCON 9  # min IFFT-parameters, enhancement factor, iprint, NCON n
>
>
> *)When I run_lapw  :
>
> 1) show dayfile :
>
> Calculating MoS2monolayer in /home/hmd/WIEN2k/MoS2monolayer
> on hmd-host with PID 5078
> using WIEN2k_23.2 (Release 9/3/2022) in /home/hmd/wien2k23
>
>
>     start 	(20 جويلية, 2023 CET 10:39:58 م) with lapw0 (40/99 to go)
>
>     cycle 1 	(20 جويلية, 2023 CET 10:39:58 م) 	(40/99 to go)
>
> >   lapw0      	(22:39:58) 0.000u 0.000s 0:00.00 0.0%	0+0k 0+8io 0pf+0w
> error: command   /home/hmd/wien2k23/lapw0 lapw0.def   failed
>
> >   stop error
>
> 2) show STDOUT:
>
> /home/hmd/wien2k23/lapw0: Command not found.
> grep: *scf1*: No such file or directory
> grep: lapw2*.error: No such file or directory
> grep: lapw2*.error: No such file or directory
> grep: lapw2*.error: No such file or directory
> grep: lapw2*.error: No such file or directory
> grep: lapw2*.error: No such file or directory
> grep: lapw2*.error: No such file or directory
> grep: lapw1*.error: No such file or directory
> grep: lapw1*.error: No such file or directory
>
> >   stop error
>
> *)Error files :
>  No error files .
>
> Thanks
>
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-- 
Professor Laurence Marks (Laurie)
Department of Materials Science and Engineering
Northwestern University
www.numis.northwestern.edu
"Research is to see what everybody else has seen, and to think what nobody
else has thought", Albert Szent-Györgyi
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