[Wien] Hi calculation elastic constants of hexagonal structure error

[delamora]

So what is your question???

You should present the problem, then explain what happened and at the end try to ask the question.

Here you present only what came out in the screen and you expect that people will decipher it.


Pablo

________________________________
De: Wien <wien-bounces at zeus.theochem.tuwien.ac.at> en nombre de guendouz nadin <guendouz.nadin at yahoo.fr>
Enviado: sábado, 10 de diciembre de 2016 10:12:09 a. m.
Para: wien at zeus.theochem.tuwien.ac.at
Asunto: [Wien] Hi calculation elastic constants of hexagonal structure error

inversion is NOT present
>   input files for lapw1c/2c prepared, no inversion present   (14:36:47)
 next is kgen
forrtl: severe (24): end-of-file during read, unit 20, file /home/nadin/WIEN2k/KZnSb-Wurtz-GGA/elast-constant/c11+c12/KZnSb-Wurtz-GGA/KZnSb-Wurtz-GGA.struct

Image              PC                Routine            Line        Source
kgen               00000000004895AE  Unknown               Unknown  Unknown
kgen               0000000000488046  Unknown               Unknown  Unknown
kgen               00000000004634C2  Unknown               Unknown  Unknown
kgen               0000000000451B0C  Unknown               Unknown  Unknown
kgen               000000000045102C  Unknown               Unknown  Unknown
kgen               000000000041DB30  Unknown               Unknown  Unknown
kgen               0000000000402DCA  Unknown               Unknown  Unknown
kgen               000000000040276C  Unknown               Unknown  Unknown
libc.so.6          00002B41B76E6B05  Unknown               Unknown  Unknown
kgen               0000000000402669  Unknown               Unknown  Unknown
 n stop error n
cp: cannot stat 'KZnSb-Wurtz-GGA.clmsum': No such file or directory
new_super.clmsum not present, no extrapolation in this cycle
starting parallel dstart at Fri Dec  9 14:36:47 EET 2016
-------- .machine0 : processors
running dstart in single mode
ERROR IN STRUCT FILE READ
**  dstart crashed!
cat: No match.
0.020u 0.012s 0:00.07 42.8%            0+0k 0+56io 0pf+0w
error: command   /home/nadin/Wien14/dstartpara -c dstart.def   failed
no KZnSb-Wurtz-GGA.clmsum(_old) file found, which is necessary for lapw0 !

>   stop error
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