[Wien] hup: Command not found. Invalid null command.

AJAY SINGH VERMA ajay_phy at hotmail.com
Tue Apr 12 15:06:04 CEST 2011



thanks sir it now works but now x lapw2 -qtl  is giving error.i hd attached LAPW2 - Error file along with the mail.

 asverma at asverma-desktop:~/WORK/ni$ runsp_lapw -cc 0.0001
hup: Command not found.
 LAPW0 END
 LAPW1 END
 LAPW1 END
 LAPW2 END
 LAPW2 END
 CORE  END
 CORE  END
 MIXER END
in cycle 2    ETEST: 0   CTEST: 0
hup: Command not found.
 LAPW0 END
 LAPW1 END
 LAPW1 END
 LAPW2 END
 LAPW2 END
 CORE  END
 CORE  END
 MIXER END
in cycle 3    ETEST: 0   CTEST: 0
hup: Command not found.
 LAPW0 END
 LAPW1 END
 LAPW1 END
 LAPW2 END
 LAPW2 END
 CORE  END
 CORE  END
 MIXER END
in cycle 4    ETEST: .0230757550000000   CTEST: .1654985
hup: Command not found.
 LAPW0 END
 LAPW1 END
 LAPW1 END
 LAPW2 END
 LAPW2 END
 CORE  END
 CORE  END
 MIXER END
in cycle 5    ETEST: .0113544800000000   CTEST: .1283146
hup: Command not found.
 LAPW0 END
 LAPW1 END
 LAPW1 END
 LAPW2 END
 LAPW2 END
 CORE  END
 CORE  END
 MIXER END
in cycle 6    ETEST: .0020342650000000   CTEST: .0499207
hup: Command not found.
 LAPW0 END
 LAPW1 END
 LAPW1 END
 LAPW2 END
 LAPW2 END
 CORE  END
 CORE  END
 MIXER END
in cycle 7    ETEST: .0005919550000000   CTEST: .0122392
hup: Command not found.
 LAPW0 END
 LAPW1 END
 LAPW1 END
 LAPW2 END
 LAPW2 END
 CORE  END
 CORE  END
 MIXER END
in cycle 8    ETEST: .0002712850000000   CTEST: .0057058
hup: Command not found.
 LAPW0 END
 LAPW1 END
 LAPW1 END
 LAPW2 END
 LAPW2 END
 CORE  END
 CORE  END
 MIXER END
in cycle 9    ETEST: .0000106350000000   CTEST: .0009158
hup: Command not found.
 LAPW0 END
 LAPW1 END
 LAPW1 END
 LAPW2 END
 LAPW2 END
 CORE  END
 CORE  END
 MIXER END
in cycle 10    ETEST: .0000048300000000   CTEST: .0000457
hup: Command not found.
 LAPW0 END
 LAPW1 END
 LAPW1 END
 LAPW2 END
 LAPW2 END
 CORE  END
 CORE  END
 MIXER END
in cycle 11    ETEST: .0000030300000000   CTEST: .0001367
hup: Command not found.
 LAPW0 END
 LAPW1 END
 LAPW1 END
 LAPW2 END
 LAPW2 END
 CORE  END
 CORE  END
 MIXER END

>   stop
asverma at asverma-desktop:~/WORK/ni$ save_lapw 3000
Fallback to compatibility mode with "old" save_lapw
broyden files deleted, clm*, dmat*, vorb*, vresp*, eece*, scf and struct files saved under 3000
asverma at asverma-desktop:~/WORK/ni$ rm *.bro*
rm: cannot remove `*.bro*': No such file or directory
asverma at asverma-desktop:~/WORK/ni$ tail *.dayfile
>   lapw1  -dn        (18:32:17) 2.1u 0.1s 0:02.40 95.0% 0+0k 0+1960io 0pf+0w
>   lapw2 -up       (18:32:20) 1.0u 0.0s 0:01.46 79.4% 0+0k 0+248io 0pf+0w
>   lapw2 -dn       (18:32:22) 0.9u 0.0s 0:01.26 77.7% 0+0k 0+248io 0pf+0w
>   lcore -up    (18:32:23) 0.0u 0.0s 0:00.00 0.0% 0+0k 0+128io 0pf+0w
>   lcore -dn    (18:32:23) 0.0u 0.0s 0:00.01 0.0% 0+0k 0+128io 0pf+0w
>   mixer     (18:32:24) 0.0u 0.0s 0:00.25 40.0% 0+0k 0+808io 0pf+0w
:ENERGY convergence:  0 0 .0000020650000000
:CHARGE convergence:  1 0.0001 -.0000340

>   stop
asverma at asverma-desktop:~/WORK/ni$ x lapw2 -qtl
LAPW2 - Error. Check file lapw2.error
0.0u 0.0s 0:00.00 0.0% 0+0k 0+8io 0pf+0w
asverma at asverma-desktop:~/WORK/ni$ 








> Date: Tue, 12 Apr 2011 14:42:46 +0200
> From: Stefaan.Cottenier at UGent.be
> To: wien at zeus.theochem.tuwien.ac.at
> Subject: Re: [Wien] hup: Command not found. Invalid null command.
> 
> 
> > I used but getting again the same error.
> 
> Repeat the initialization and the runsp in a new, clean directory, 
> containing only the case.struct file at first. Once you start mixing 
> non-spinpolarized and spinpolarized calculations in the same directory, 
> things usually get messed up.
> 
> Stefaan
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
 		 	   		  
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