[Wien] [Wien2k Users] QTL Error in DOS calculations
Peter Blaha
pblaha at theochem.tuwien.ac.at
Tue Apr 13 07:51:25 CEST 2010
No you don't have "the same error".
His error says:
> qtl 0000000000418409 MAIN__ 607 > qtlmain.f
Which means the line number in subroutine qtlmain.
From this I can see that he probably made a stupid input input error,
because the code comes to this line only for option 88/99, not for
normal operation.
-----------------------------------------------
Your error says:
forrtl: severe (24): end-of-file during read, unit 60, file
/home/WIEN2k/case1/Mn.cf10
qtl 0805F522 MAIN__ 400 qtlmain.f
Checking the latest release, I can see that at line 400 NOTHING is read.
So you are using an old version, maybe together with some incompatible
input,....
One does not need a case.cf10 file anymore unless you are a "specialist".
Am 13.04.2010 03:40, schrieb crazy Li:
> I have the same error information!
> appreciate any suggestin!
> Thanks a lot!
>
> 2010/3/19 Ghosh SUDDHASATTWA <ssghosh at igcar.gov.in
> <mailto:ssghosh at igcar.gov.in>>
>
> Dear Wien2k Users,
>
> The following error came while calculating DOS for our case
>
> forrtl: severe (24): end-of-file during read, unit 1001, file
> /group5/cg/sghosh/WIEN2k/lapw/Hexagonal_Zirconium/Hexagonal_Zirconium.qtlatom_1
>
> Image PC Routine Line
> Source
>
> qtl 0000000000512AFE Unknown Unknown
> Unknown
>
> qtl 0000000000511A90 Unknown Unknown
> Unknown
>
> qtl 00000000004CCBFE Unknown Unknown
> Unknown
>
> qtl 0000000000495817 Unknown Unknown
> Unknown
>
> qtl 00000000004950F4 Unknown Unknown
> Unknown
>
> qtl 00000000004AEC20 Unknown Unknown
> Unknown
>
> qtl 0000000000418409 MAIN__ 607
> qtlmain.f
>
> qtl 0000000000404DC2 Unknown Unknown
> Unknown
>
> libc.so.6 00000039FBC1D8A4 Unknown Unknown
> Unknown
>
> qtl 0000000000404CE9 Unknown Unknown
> Unknown
>
> 4.430u 1.981s 0:09.98 64.2% 0+0k 0+0io 14pf+0w
>
> error: command /appl/wien/qtl qtl.def failed
>
> We need some help
>
> Suddhasattwa
>
>
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--
Peter Blaha
Inst.Materialchemie, TU Wien
Getreidemarkt 9
A-1060 Vienna
Austria
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