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Error while executing program
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Topic: Error while executing program (Read 3460 times)
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Val
Regular QuantumATK user
Posts: 22
Reputation: 0
Error while executing program
«
on:
January 28, 2011, 05:21 »
sir,
when i run my program i got error like
Calculating DOS : MKL ERROR : Parameter 7 was incorrect on entry to ZHSEQR
info=-7
** Back Engine Exception 1 : ritzEigenvaluesComplex : zhseqr failed !
** Location : qep.cpp:386
terminate called after throwing an instance of 'MathException'
/opt/QuantumWise/atk-10.8.2/atkpython/bin/atkpython: line 3: 8738 Aborted PSEUDOPOTENTIALS_PATH=$EXEC_DIR/../share/pseudopotentials GPAW_SETUP_PATH=$EXEC_DIR/../share/gpaw-setups/ PYTHONHOME=$EXEC_DIR/.. PYTHONPATH= LD_LIBRARY_PATH=$EXEC_DIR/../lib $EXEC_DIR/atkpython_exec $*
NanoLanguageScript execution failure
could you help me to rectify the problem.
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kstokbro
Supreme QuantumATK Wizard
Posts: 392
Reputation: 13
Re: Error while executing program
«
Reply #1 on:
January 29, 2011, 07:53 »
Next week we will have a beta version of 11.2, let us know if the problem is solved in this version.
For future bug reports please attach the input script such that we can reproduce the bug, else it is not possible for us to verify and solve the bug
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Error while executing program