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add a job to extract the branch name for the CI
Continuous Integration #1158: Commit 1e7d4c8 pushed by JacksonBurns
July 31, 2023 15:57 11m 47s regression-to-database
July 31, 2023 15:57 11m 47s
Added freq scaling factor for wb97m-v/def2-tzvp
Continuous Integration #1157: Commit 336c12b pushed by alongd
July 31, 2023 11:09 37m 37s wb97mv
July 31, 2023 11:09 37m 37s
NH3
Continuous Integration #1156: Commit a76f12a pushed by alongd
July 31, 2023 11:08 36m 34s nh3
nh3
July 31, 2023 11:08 36m 34s
NH3
Continuous Integration #1155: Commit df3de7a pushed by alongd
July 28, 2023 17:19 31m 15s nh3
nh3
July 28, 2023 17:19 31m 15s
NH3
Continuous Integration #1154: Commit 0ce4eb9 pushed by alongd
July 24, 2023 19:02 36m 44s nh3
nh3
July 24, 2023 19:02 36m 44s
Added freq scaling factor for wb97m-v/def2-tzvp
Continuous Integration #1153: Commit 885f91b pushed by alongd
July 24, 2023 17:17 33m 47s wb97mv
July 24, 2023 17:17 33m 47s
Added freq scaling factor for wb97m-v//def2-tzvp
Continuous Integration #1152: Commit 7c1ad61 pushed by alongd
July 24, 2023 17:15 30m 50s wb97mv
July 24, 2023 17:15 30m 50s
NH3
Continuous Integration #1151: Commit 6cbe865 pushed by alongd
July 24, 2023 17:12 39m 1s nh3
nh3
July 24, 2023 17:12 39m 1s
fixed A units for bimolecular rxns by multiplying by avgadro number
Continuous Integration #1150: Commit cb94f41 pushed by NellyMitnik
July 24, 2023 09:21 28m 58s Furfuryl
July 24, 2023 09:21 28m 58s
f NH3
Continuous Integration #1149: Commit 31dbc8d pushed by alongd
July 23, 2023 03:07 43m 10s nh3
nh3
July 23, 2023 03:07 43m 10s
f
Continuous Integration #1148: Commit 6515350 pushed by alongd
July 22, 2023 03:47 32m 15s api_db
July 22, 2023 03:47 32m 15s
added libs
Continuous Integration #1147: Commit fe89c48 pushed by NellyMitnik
July 18, 2023 07:27 33m 19s Furfuryl
July 18, 2023 07:27 33m 19s
Temp: Use Py branch for tests
Continuous Integration #1146: Commit 3dd4b92 pushed by rwest
July 15, 2023 19:18 31m 58s update_atom_enthalpies
July 15, 2023 19:18 31m 58s
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