| 3:50:54 AM PDT - Fri, Nov 4th 2011 |
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Hello everyone.
I have the following problem with getting NWChem 6.0 running on a cluster.
I have compiled it with icc & ifort, with ARMCI enabled, and trying to run with mvapich on a cluster.
I have 16 logical processes available to the mpirun.
When I use 8 processes, everything is OK without any modifications.
When I run it with 16 processes it crashes with two possibilities.
With MEMORY 200 mb in the input deck
MA error: MA_init: could not allocate 104857808 bytes
With less MEMORY (say, MEMORY 50 mb)
it runs, but fails on
Symmetry analysis of molecular orbitals - initial
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(rank:7 hostname:node-63-09 pid:18522):ARMCI DASSERT fail. openib.c:armci_pin_contig_hndl():989 cond:(memhdl->memhndl!=((void *)0))
(rank:0 hostname:node-63-09 pid:18515):ARMCI DASSERT fail. openib.c:armci_pin_contig_hndl():989 cond:(memhdl->memhndl!=((void *)0))
Last System Error Message from Task 0:: Bad address
Exit code -3 signaled from node-63-09
Am I missing something?
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