Update atom enthalpies

[cgrambow]

Corresponds to ReactionMechanismGenerator/RMG-database#416. Fixes unit tests that are affected by the updated enthalpies.

[codecov[bot]]

Codecov Report

Merging #1955 (2a16b73) into main (215eb1b) will decrease coverage by 1.37%. The diff coverage is n/a.

:exclamation: Current head 2a16b73 differs from pull request most recent head ada3bd8. Consider uploading reports for the commit ada3bd8 to get more accurate results

@@            Coverage Diff             @@
##             main    #1955      +/-   ##
==========================================
- Coverage   48.57%   47.20%   -1.37%     
==========================================
  Files         110      104       -6     
  Lines       30812    27706    -3106     
  Branches     8054     7133     -921     
==========================================
- Hits        14968    13080    -1888     
+ Misses      14320    13220    -1100     
+ Partials     1524     1406     -118     

see 60 files with indirect coverage changes

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[github-actions[bot]]

This pull request is being automatically marked as stale because it has not received any interaction in the last 90 days. Please leave a comment if this is still a relevant pull request, otherwise it will automatically be closed in 30 days.

[amarkpayne]

Just commenting here to keep this alive for a bit longer. We'll probably want this in for the BAC paper @oscarwumit , but if I remember correctly this needed to wait for some other stuff to get in.

[JacksonBurns]

Changing base to main to see how out of date this is.

[JacksonBurns]

The only file in conflict is the CI.yml. I'm going to resolve this, and then it needs a look over @oscarwumit @cgrambow @amarkpayne

[rwest]

I rebased this and https://github.com/ReactionMechanismGenerator/RMG-database/pull/416

There's discussion on there between @cgrambow and @amarkpayne. But I see it was referenced by https://github.com/ReactionMechanismGenerator/RMG-database/pull/421 which says it depends on https://github.com/ReactionMechanismGenerator/RMG-database/pull/416 and also https://github.com/ReactionMechanismGenerator/RMG-database/pull/418 Then that was mentioned by https://github.com/ReactionMechanismGenerator/RMG-database/pull/603

I'm now rather confused - does @alongd (who wrote https://github.com/ReactionMechanismGenerator/RMG-database/pull/603 which seems to be one of the most recent) know what's going on? Which of these should be merged and which should be closed without merging?

[github-actions[bot]]

This pull request is being automatically marked as stale because it has not received any interaction in the last 90 days. Please leave a comment if this is still a relevant pull request, otherwise it will automatically be closed in 30 days.