RMG-database release v3.2.0 #590
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…le` to halogens folder in recommended families
regenerated F Abstraction groups and rules with autotst training data
removed imported reactions from literature mechanisms, and added training data from autotst calculations, then regenerated the tree and rules
removed estimated imported reactions from literature mechanisms, and added training data from autotst calculations, then regenerated the tree and rules
…_families Halogens kinetics - new families and libraries
…l2_redo Refit ketoenol2 redo
…opentadiene_scission Tree gen cyclopentadiene scission
Removed a comment from 2003_Miller kin lib
for: - B2PLYP-D3/aug-cc-pVTZ - B2PLYP-D3/cc-pVTZ
Added frequency scaling factors
Updates to the primaryNitrogenLibrary
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These commits were made directly to the stable branch for the 3.1.0 release. This PR rebases them onto main, so that we can get the branches back in sync with each other without losing them.
This preserves the stable branch as-is, so that it can be accessed later if needed, and so the tag is preserved, but does not change the code in the main branch.
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Creating new version of RMG binaries. Joint PR with RMG-Py ReactionMechanismGenerator/RMG-Py#2311