Compiling NWChem Advice....

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I got the following error message right after the initialization of the program after building NWChem following these directions:

                                NWChem DFT Module

Ti2O4 1Ag C2h BP86/aug-cc-pVDZ(-PP) TDDFT

rank 0 in job 5 computea-01_34827 caused collective abort of all ranks
 exit status of rank 0: killed by signal 9

I was able to run a simple H2O calculation, but as soon as I run a little larger calculation, the job failed. I am using the following compilers and libraries:

Interconnect is OpenIB.
And I am running on a single node.

Any help will be greatly appreciated.

Edited On 12:14:40 AM PDT - Mon, Jun 13th 2011 by Shenggangli

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