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Fixed xtb multiplicity for multiplicities other than 1
CI #188: Commit 034c447 pushed by RaphaelRobidas
November 13, 2024 16:48 30s main
November 13, 2024 16:48 30s
Adjusted NWChem specification parsing
CI #187: Commit 9744e28 pushed by RaphaelRobidas
September 1, 2024 15:51 27s main
September 1, 2024 15:51 27s
Changed how ORCA specifications work
CI #186: Commit 2806dcd pushed by RaphaelRobidas
August 29, 2024 15:15 34s main
August 29, 2024 15:15 34s
Switched ORCA specifications to a more modular approach
CI #185: Commit f6112fa pushed by RaphaelRobidas
August 29, 2024 14:38 37s main
August 29, 2024 14:38 37s
August 26, 2024 16:19 3m 43s
Made error message slightly more verbose
CI #183: Commit 3300080 pushed by RaphaelRobidas
June 4, 2024 17:04 30s main
June 4, 2024 17:04 30s
Merge pull request #17 from corcoted/corcoted
CI #182: Commit 06fc6c2 pushed by RaphaelRobidas
June 4, 2024 17:00 33s main
June 4, 2024 17:00 33s
Updated docs requirements
CI #180: Commit 0be6b6c pushed by RaphaelRobidas
January 15, 2024 19:35 46s main
January 15, 2024 19:35 46s
Fixed memory specification
CI #179: Commit d9c84e1 pushed by RaphaelRobidas
January 15, 2024 16:03 2m 14s main
January 15, 2024 16:03 2m 14s
Fixed docs
CI #178: Commit cd412fc pushed by RaphaelRobidas
October 8, 2023 17:51 54s main
October 8, 2023 17:51 54s
Added missing file for documentation building
CI #177: Commit 81d9c90 pushed by RaphaelRobidas
October 8, 2023 17:48 1m 2s main
October 8, 2023 17:48 1m 2s
October 8, 2023 17:33 53s