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Adjusted NWChem specification parsing Lint #109: Commit 9744e28 pushed by RaphaelRobidas
September 1, 2024 15:51 19s main
main
September 1, 2024 15:51 19s
Changed how ORCA specifications work Lint #108: Commit 2806dcd pushed by RaphaelRobidas
August 31, 2024 17:43 14s v1.11.0
v1.11.0
August 31, 2024 17:43 14s
Changed how ORCA specifications work Lint #107: Commit 2806dcd pushed by RaphaelRobidas
August 29, 2024 15:15 18s main
main
August 29, 2024 15:15 18s
Switched ORCA specifications to a more modular approach Lint #106: Commit f6112fa pushed by RaphaelRobidas
August 29, 2024 14:38 18s main
main
August 29, 2024 14:38 18s
Fixed bug where extra lines in input files would mistakingly be count… Lint #105: Commit 17c1411 pushed by RaphaelRobidas
August 26, 2024 16:19 18s main
main
August 26, 2024 16:19 18s
Fixed bug where extra lines in input files would mistakingly be count… Lint #104: Commit 17c1411 pushed by RaphaelRobidas
August 26, 2024 16:19 17s v1.10.5
v1.10.5
August 26, 2024 16:19 17s
Made error message slightly more verbose Lint #103: Commit 3300080 pushed by RaphaelRobidas
June 4, 2024 17:04 31s v1.10.4
v1.10.4
June 4, 2024 17:04 31s
Made error message slightly more verbose Lint #102: Commit 3300080 pushed by RaphaelRobidas
June 4, 2024 17:04 19s main
main
June 4, 2024 17:04 19s
Merge pull request #17 from corcoted/corcoted Lint #101: Commit 06fc6c2 pushed by RaphaelRobidas
June 4, 2024 17:00 20s main
main
June 4, 2024 17:00 20s
Updated docs requirements Lint #100: Commit 0be6b6c pushed by RaphaelRobidas
January 15, 2024 19:35 14s main
main
January 15, 2024 19:35 14s
Fixed memory specification Lint #99: Commit d9c84e1 pushed by RaphaelRobidas
January 15, 2024 16:04 22s v1.10.3
v1.10.3
January 15, 2024 16:04 22s
Fixed memory specification Lint #98: Commit d9c84e1 pushed by RaphaelRobidas
January 15, 2024 16:03 21s main
main
January 15, 2024 16:03 21s
Fixed docs Lint #97: Commit cd412fc pushed by RaphaelRobidas
October 8, 2023 17:51 21s main
main
October 8, 2023 17:51 21s
Added missing file for documentation building Lint #96: Commit 81d9c90 pushed by RaphaelRobidas
October 8, 2023 17:48 22s main
main
October 8, 2023 17:48 22s
Added support for --molden and --json output specifications in xtb Lint #95: Commit 2fdb981 pushed by RaphaelRobidas
October 8, 2023 17:34 16s v1.10.2
v1.10.2
October 8, 2023 17:34 16s
Added support for --molden and --json output specifications in xtb Lint #94: Commit 2fdb981 pushed by RaphaelRobidas
October 8, 2023 17:33 21s main
main
October 8, 2023 17:33 21s
Updated the documentation Lint #93: Commit c423769 pushed by RaphaelRobidas
August 26, 2023 20:28 21s main
main
August 26, 2023 20:28 21s
Added concerted xtb scans Lint #92: Commit a55d031 pushed by RaphaelRobidas
August 21, 2023 15:03 19s v1.10.1
v1.10.1
August 21, 2023 15:03 19s
Added concerted xtb scans Lint #91: Commit a55d031 pushed by RaphaelRobidas
August 21, 2023 13:56 16s main
main
August 21, 2023 13:56 16s
Added the list of contributors in the README Lint #90: Commit 30bab85 pushed by RaphaelRobidas
July 17, 2023 21:05 19s main
main
July 17, 2023 21:05 19s
Fixed docs and minor tweaks Lint #89: Commit 529d38a pushed by RaphaelRobidas
July 15, 2023 13:13 16s v1.10.0
v1.10.0
July 15, 2023 13:13 16s
Fixed docs and minor tweaks Lint #88: Commit 529d38a pushed by RaphaelRobidas
July 15, 2023 13:12 23s main
main
July 15, 2023 13:12 23s
Merge pull request #16 from zarkoivkovicc/nwchem Lint #87: Commit 65f996a pushed by RaphaelRobidas
July 15, 2023 13:02 21s main
main
July 15, 2023 13:02 21s