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Sella env fix (#711)
Update cache #66: Commit 7f5190d pushed by calvinp0
November 14, 2023 09:59 10m 32s main
November 14, 2023 09:59 10m 32s
Update cache
Update cache #65: Scheduled
November 8, 2023 00:29 2m 29s main
November 8, 2023 00:29 2m 29s
Dockerfile (#710)
Update cache #64: Commit d756403 pushed by alongd
November 2, 2023 19:37 2m 15s main
November 2, 2023 19:37 2m 15s
Update cache
Update cache #63: Scheduled
November 1, 2023 00:30 2m 5s main
November 1, 2023 00:30 2m 5s
Orca 5 sol (#709)
Update cache #62: Commit bdaa2a3 pushed by alongd
October 30, 2023 19:41 2m 31s main
October 30, 2023 19:41 2m 31s
Update cache
Update cache #61: Scheduled
October 29, 2023 00:30 2m 12s main
October 29, 2023 00:30 2m 12s
Report electronic energy in an output file (#708)
Update cache #60: Commit 6b51ce5 pushed by alongd
October 23, 2023 18:54 2m 34s main
October 23, 2023 18:54 2m 34s
Update cache
Update cache #59: Scheduled
October 22, 2023 00:31 2m 15s main
October 22, 2023 00:31 2m 15s
Update cache
Update cache #58: Scheduled
October 15, 2023 00:31 2m 6s main
October 15, 2023 00:31 2m 6s
Update cache
Update cache #57: Scheduled
October 8, 2023 00:31 1m 59s main
October 8, 2023 00:31 1m 59s
Scan l103 (#687)
Update cache #56: Commit 067e76c pushed by kfir4444
October 5, 2023 10:07 3m 0s main
October 5, 2023 10:07 3m 0s
Don't report convergence for IRC species (#705)
Update cache #55: Commit 6e84f83 pushed by alongd
October 4, 2023 22:16 2m 14s main
October 4, 2023 22:16 2m 14s
Fixed: allow mutiple scissions in the atom mapping process. (#701)
Update cache #54: Commit 3aceebc pushed by alongd
October 3, 2023 05:36 3m 48s main
October 3, 2023 05:36 3m 48s
Improved TS energy checks (#690)
Update cache #53: Commit 5c3aab6 pushed by kfir4444
October 2, 2023 09:27 1m 56s main
October 2, 2023 09:27 1m 56s
Update cache
Update cache #52: Scheduled
October 1, 2023 00:33 2m 4s main
October 1, 2023 00:33 2m 4s
Update cache
Update cache #51: Scheduled
September 29, 2023 00:28 2m 2s main
September 29, 2023 00:28 2m 2s
Changed the default of load_families_only (#704)
Update cache #50: Commit 82d915d pushed by MichalKesl
September 28, 2023 08:14 2m 4s main
September 28, 2023 08:14 2m 4s
Update cache
Update cache #49: Scheduled
September 22, 2023 00:28 2m 29s main
September 22, 2023 00:28 2m 29s
Fix Molpro opt input file (#698)
Update cache #48: Commit 753d74a pushed by alongd
September 21, 2023 16:47 2m 27s main
September 21, 2023 16:47 2m 27s
Update cache
Update cache #47: Scheduled
September 15, 2023 00:28 2m 13s main
September 15, 2023 00:28 2m 13s
Update cache
Update cache #46: Scheduled
September 8, 2023 00:27 2m 15s main
September 8, 2023 00:27 2m 15s
Allowing atom mapping of molecules with multiplicity of the same spec…
Update cache #45: Commit 617b2c5 pushed by alongd
September 4, 2023 04:37 2m 5s main
September 4, 2023 04:37 2m 5s
Update cache
Update cache #44: Scheduled
September 1, 2023 00:30 3m 5s main
September 1, 2023 00:30 3m 5s
Make sure to update, upgrate and autoremove before latex installation…
Update cache #43: Commit 5d5fc3a pushed by alongd
August 29, 2023 12:43 2m 48s main
August 29, 2023 12:43 2m 48s
Update cache
Update cache #42: Scheduled
August 29, 2023 00:27 2m 56s main
August 29, 2023 00:27 2m 56s