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

AJAY SINGH VERMA ajay_phy at hotmail.com
Tue Apr 12 14:35:51 CEST 2011


I used but getting again the same error.

asverma at asverma-desktop:~/WORK/ni$ runsp_lapw -cc 0.0001
hup: Command not found.
 LAPW0 END
 LAPW1 END

>   stop error
asverma at asverma-desktop:~/WORK/ni$







> Date: Tue, 12 Apr 2011 14:28:50 +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.
> 
> 
> > -----> do you want to perform a spinpolarized calculation ? (n/y)
> > y
> >  > dstart -up (17:34:12) DSTART ENDS
> > 0.7u 0.0s 0:01.32 59.0% 0+0k 0+192io 0pf+0w
> >  > dstart -dn (17:34:14) DSTART ENDS
> > 0.7u 0.0s 0:01.18 66.1% 0+0k 0+192io 0pf+0w
> > -----> do you want to perform an antiferromagnetic calculation ? (N/y)
> > N
> 
> The output above shows you initialize this as a spin-polarized case, 
> while the lines hereunder show you run it as being non-spinpolarized:
> 
> > asverma at asverma-desktop:~/WORK/ni$ run_lapw -cc 0.0001
> > hup: Command not found.
> > LAPW0 END
> > LAPW1 - Error
> 
> Solution: use runsp_lapw rather than run_lapw
> 
> Stefaan
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