Community development of ECCE


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Gets Around
Hi Matt,
I'm interested in helping make sure that ECCE keeps running.

I wonder if the debian project would be interested, seeing as they package nwchem as well. Obviously PNL would have to sort out the copyright, which they might not want to/be able to.

As far as slurm goes it works for me -- no issues on my personal cluster as well as two other commodity clusters.

In what way, specifically, is the output not correctly parsed? Something subtle or does it stuff everything up?