Re: MRCI: Error in IJKL IVL.

Posted by Per Ake Malmqvist on October 12, 2002 at 12:16:45:

In Reply to: MRCI: Error in IJKL IVL. posted by Jose Luis Pascual on October 10, 2002 at 12:03:56:

Dear JLP (and others): A few years back, a number of test statement were inserted in
the MRCI program to check unpacking of indices. They have not tripped before, and the
error message is very cryptic. Please send this in as a bug report -- i.e., send it with
a tar file with all inputs, so we can reproduce the error and correct the bug.
Best Regards,
Per Ake

: I'm running MOLCAS 5.2 in a PC (AthlonXP) under Red Hat
: Linux 7.3, using GNU gcc-3.0.4 to compile it. The tests
: with 'molcas verify' went OK. But, when running ACPF calculations
: on relatively big systems, the mrci module stops with a message
: that reads 'Error in IJKL IVL.'

: Any idea of what can go wrong??

: Thanks in advance

: JLP

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: : Dear JLP (and others): A few years back, a number of test statement were inserted in : the MRCI program to check unpacking of indices. They have not tripped before, and the : error message is very cryptic. Please send this in as a bug report -- i.e., send it with : a tar file with all inputs, so we can reproduce the error and correct the bug. : Best Regards, : Per Ake : : I'm running MOLCAS 5.2 in a PC (AthlonXP) under Red Hat : : Linux 7.3, using GNU gcc-3.0.4 to compile it. The tests : : with 'molcas verify' went OK. But, when running ACPF calculations : : on relatively big systems, the mrci module stops with a message : : that reads 'Error in IJKL IVL.' : : Any idea of what can go wrong?? : : Thanks in advance : : JLP