[Wien] Error with new update

Peter Blaha pblaha at theochem.tuwien.ac.at
Fri Jun 5 21:19:41 CEST 2015


I'd expect there is another error during initialization before.

a) Try some other simple examples. Does it happen always ?

b) The case.in0 file is ok before dstart is running (it is the same as 
case.in0_st) and only dstart should add additional data to it (writing 
case.in0_std.


Am 05.06.2015 um 17:47 schrieb B Tankhilsaihan:
> Hello Dear Peter Blaha and Wien2k Users
> I was running in Wien2k_13.1 then few days ago I updated to 14.2.
> I downloaded full package and installed it by following instruction.
> But unfortunately I got error with "x dstart" when I do initialization.
>
> forrtl: severe (24): end-of-file during read, unit 14, file /home/wgfkp/WIEN2k/c-mini/c-mini.in0
> Image              PC                Routine            Line        Source
> dstart             0000000000455C26  Unknown               Unknown  Unknown
> dstart             00000000004108D6  make_inter_                35  make_inter.F
> dstart             000000000040D988  MAIN__                     21  dstart.F
> dstart             0000000000402ED6  Unknown               Unknown  Unknown
> libc.so.6          00002B03237DDA40  Unknown               Unknown  Unknown
> dstart             0000000000402DC9  Unknown               Unknown  Unknown
> 3.4u 0.1s 0:03.98 88.9% 0+0k 16232+13128io 45pf+0w
> error: command   /home/wgfkp/wien2k/dstart dstart.def   failed
>
> Then I checked case.in0 file but it is incomplete.
> It shows only following lines
>
>
> TOT  XC_PBE     (XC_LDA,XC_PBESOL,XC_WC,XC_MBJ,XC_REVTPSS)
> NR2V
>
> I asked it previously and got respond from Gavin Abo. He said that it is
> maybe because of format diffrence between old and new version.
> If so how can I fix it?
> Thanks in advance
>
> Regards
> Batsaikhan.T
>
>
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-- 
Peter Blaha
Inst.Materials Chemistry
TU Vienna
Getreidemarkt 9
A-1060 Vienna
Austria
+43-1-5880115671


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