[Wien] mini error

Santhy Jaiker k_santhy79 at yahoo.co.in
Tue Jul 28 07:53:03 CEST 2009


Dear wien2k users,
 
I am running minimization, with varying 7 different volume of a structure with fixd A:B:C ratio.  That's same as in optimization notes.  After running two structures, it stopped with error.  The forces are minimized for calculated two structures, but error shows for third one. i listed the error displays in various files.
 
lapw2.error   -- Error in lapw2
case.dayfile -- lapw2.def failed
mini.error    --STOP  in MINI, FORCES small
wien2k.err(error file for parallel running)---
 
forrtl: severe (24): end-of-file during read, unit 10, file /...../case.vector
Image              PC                Routine            Line        Source             
lapw2              00000000007E892E  Unknown               Unknown  Unknown
lapw2              00000000007E78C0  Unknown               Unknown  Unknown
lapw2              00000000007A3AFA  Unknown               Unknown  Unknown
lapw2              0000000000767F2B  Unknown               Unknown  Unknown
lapw2              0000000000767808  Unknown               Unknown  Unknown
lapw2              0000000000780182  Unknown               Unknown  Unknown
lapw2              000000000045FA3D  Unknown               Unknown  Unknown
lapw2              00000000004733F6  Unknown               Unknown  Unknown
lapw2              0000000000413662  Unknown               Unknown  Unknown
libc.so.6          00000038C571C3FB  Unknown               Unknown  Unknown
lapw2              00000000004135AA  Unknown               Unknown  Unknown
 
Wien2k.out (output file for parallel running) --
>;   stop error
>;>;>; (min) status after run_lapw -I -fc 1.0 -i 400 -ec 0.0001 -cc 0.0001 \: 9 ->; exit
ERROR status in case_vol__-4.0

anyone come accross this kind of error?
 
Regards,
Santhy Jaiker
 
Research Scholar 
Materials Thermodynamics Lab
Department of Metallurgical and Materials Engineering
Indian Institute of Technology Madras
Chennai - 600 036
India
Tel: 91-044-22575763
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