Molecular dynamics example


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Hi,

I'm trying to run one of the MD examples that come with the program, the one in /nwchem/examples/md/ache/mache.nw.
It returns an error, apparently in the prepare phase. Next are the last few lines of the output file.


Created restart mache_md.rst


Task  times  cpu:        5.3s     wall:        5.7s


                               NWChem Input Module
-------------------



**********
* 0: Failed to create global array s 0
**********
0:0::: 0
(rank:0 hostname:diegoa pid:7675):ARMCI DASSERT fail. armci.c:ARMCI_Error():260 cond:0
 0: ARMCI aborting 0 (0).
0: ARMCI aborting 0 (0).


Any idea why?

Thanks in advance

Diego