WIP: Added json conversion of NWChem to workflow#557

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chetnieter wants to merge 9 commits intomasterfrom

nwchem-json-generation

Commits on Dec 8, 2016

Commits on Dec 12, 2016

Initial Dockerfile for nwchem-json container.
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committed

Commits on Dec 14, 2016

Using docker container for nwchem json conversion.
chetnieter
committed

Commits on Dec 15, 2016

Passing in nwchem output filename on command line.
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committed

Commits on Dec 16, 2016

Clean up before pausing work.
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committed

Commits on Dec 18, 2016

Merge branch 'master' into nwchem-json-generation
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Commits on Dec 19, 2016

Changes from code review.
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