From NWChem
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Edoapra Forum:Admin, Forum:Mod, bureaucrat, sysop
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Forum Vet
Threads 7
Posts 1088
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12:11:54 PM PDT - Mon, Oct 15th 2012 |
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Chaitanya,
Have tried to debug what call is causing the Segmentation Violation error?
To make things simpler, I would suggest to compile first with any MKL library to link against (including Scalapack),
have you tried it already?
I suggest to recompile NWChem without redefining FOPTIMIZE and COPTIMIZE, too, and use gcc as C compiler.
Cheers, Edo
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