exa-analytics / exatomic

A unified platform for theoretical and computational chemists
https://exa-analytics.github.io/exatomic
Apache License 2.0
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Issue 230 #234

Closed avmarchenko closed 2 years ago

avmarchenko commented 2 years ago

first PR in the series. This PR takes the base exa package (frozen from stable) and injects it into exatomic. Next PR will shift imports. Sorry about the commit messages. first pr of 3 I think. next will switch imports and last will remove exa clone/install from from ci and update requirements.txt.