[Wien] hup: command not found and invalid command
kevin chester
chester2k14 at gmail.com
Sat Aug 2 04:34:41 CEST 2014
Good day Sir
I have a problem on my wien2k_10. I have successfully installed it on
Ubuntu 12.04 LTS. During the compilation there was no error shown. But if
run a calculation (e.g x nn and the x sgroup) it shows result and Invalid
null command. Also when running the SCF, it shows hup command not found
Invalid null command.
specify nn-bondlength factor: (usually=2) [and optionally dlimit (about 1.d-5)]
DSTMAX: 20.0000000000000
ATOM 1 Ti ATOM 2 C
RMT( 1)=2.09000 AND RMT( 2)=1.85000
SUMS TO 3.94000 LT. NN-DIST= 4.08937
ATOM 2 C ATOM 1 Ti
RMT( 2)=1.85000 AND RMT( 1)=2.09000
SUMS TO 3.94000 LT. NN-DIST= 4.08937
NN ENDS
0.0u 0.0s 0:00.00 0.0% 0+0k 0+32io 0pf+0w
#using the x sgroup
Commandline: *x sgroup*
Program input is: *""*
Invalid null command.
0.0u 0.0s 0:00.00 0.0% 0+0k 0+8io 0pf+0w
#also in the SCF cycle
hup: Command not found.
Invalid null command.
LAPW0 END
Invalid null command.
LAPW1 END
Invalid null command.
LAPW2 END
Invalid null command.
CORE END
Invalid null command.
MIXER END
ec cc and fc_conv 0 0 1
in cycle 2 ETEST: .1630659300000000 CTEST: .9223692
hup: Command not found.
Invalid null command.
LAPW0 END
Invalid null command.
LAPW1 END
Invalid null command.
LAPW2 END
Invalid null command.
CORE END
Invalid null command.
MIXER END
ec cc and fc_conv 0 1 1
in cycle 3 ETEST: .0815329700000000 CTEST: -.0004331
hup: Command not found.
Invalid null command.
LAPW0 END
Invalid null command.
LAPW1 END
Invalid null command.
LAPW2 END
Invalid null command.
CORE END
Invalid null command.
MIXER END
ec cc and fc_conv 0 1 1
in cycle 4 ETEST: .0815509450000000 CTEST: -.0004820
hup: Command not found.
Invalid null command.
LAPW0 END
Invalid null command.
LAPW1 END
Invalid null command.
LAPW2 END
Invalid null command.
CORE END
Invalid null command.
MIXER END
ec cc and fc_conv 1 1 1
> stop
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