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Now passing when an error is found when reading ORCA calculations Documentation-no-Deploy #740: Commit 7eeea40 pushed by YHordijk
July 2, 2024 13:21 1m 21s 276-exception-raised-while-trying-to-read-charge-from-orca-calculations
276-exception-raised-while-trying-to-read-charge-from-orca-calculations
July 2, 2024 13:21 1m 21s
Now passing when an error is found when reading ORCA calculations Testing #1018: Commit 7eeea40 pushed by YHordijk
July 2, 2024 13:21 1m 19s 276-exception-raised-while-trying-to-read-charge-from-orca-calculations
276-exception-raised-while-trying-to-read-charge-from-orca-calculations
July 2, 2024 13:21 1m 19s
Documentation build Documentation-no-Deploy #739: Commit 4b51602 pushed by YHordijk
July 2, 2024 13:20 45s 276-exception-raised-while-trying-to-read-charge-from-orca-calculations
276-exception-raised-while-trying-to-read-charge-from-orca-calculations
July 2, 2024 13:20 45s
Documentation build Testing #1017: Commit 4b51602 pushed by YHordijk
July 2, 2024 13:20 51s 276-exception-raised-while-trying-to-read-charge-from-orca-calculations
276-exception-raised-while-trying-to-read-charge-from-orca-calculations
July 2, 2024 13:20 51s
Updated workflow files Documentation-no-Deploy #738: Commit 575805d pushed by SiebeLeDe
June 29, 2024 20:16 1m 10s SI-maker-redesign
SI-maker-redesign
June 29, 2024 20:16 1m 10s
Updated workflow files Testing #1016: Commit 575805d pushed by SiebeLeDe
June 29, 2024 20:16 1m 58s SI-maker-redesign
SI-maker-redesign
June 29, 2024 20:16 1m 58s
line too long fix Documentation-no-Deploy #737: Commit ead3197 pushed by SiebeLeDe
June 29, 2024 20:09 1m 3s SI-maker-redesign
SI-maker-redesign
June 29, 2024 20:09 1m 3s
line too long fix Testing #1015: Commit ead3197 pushed by SiebeLeDe
June 29, 2024 20:09 1m 37s SI-maker-redesign
SI-maker-redesign
June 29, 2024 20:09 1m 37s
Better folder management and fixed import issues Testing #1014: Commit cf42a43 pushed by SiebeLeDe
June 29, 2024 20:01 57s SI-maker-redesign
SI-maker-redesign
June 29, 2024 20:01 57s
Better folder management and fixed import issues Documentation-no-Deploy #736: Commit cf42a43 pushed by SiebeLeDe
June 29, 2024 20:01 1m 4s SI-maker-redesign
SI-maker-redesign
June 29, 2024 20:01 1m 4s
Improved the handling of title and make examples up to date Documentation-no-Deploy #735: Commit ce4a6b0 pushed by SiebeLeDe
June 29, 2024 19:54 1m 7s SI-maker-redesign
SI-maker-redesign
June 29, 2024 19:54 1m 7s
Improved the handling of title and make examples up to date Testing #1013: Commit ce4a6b0 pushed by SiebeLeDe
June 29, 2024 19:54 48s SI-maker-redesign
SI-maker-redesign
June 29, 2024 19:54 48s
Better formatting imaginary frequencies and titles Documentation-no-Deploy #734: Commit 3bb0084 pushed by SiebeLeDe
June 28, 2024 11:29 1m 7s SI-maker-redesign
SI-maker-redesign
June 28, 2024 11:29 1m 7s
Better formatting imaginary frequencies and titles Testing #1012: Commit 3bb0084 pushed by SiebeLeDe
June 28, 2024 11:29 55s SI-maker-redesign
SI-maker-redesign
June 28, 2024 11:29 55s
Improved xyz formatting writer Testing #1011: Commit 67af4cc pushed by SiebeLeDe
June 28, 2024 08:09 55s SI-maker-redesign
SI-maker-redesign
June 28, 2024 08:09 55s
Improved xyz formatting writer Documentation-no-Deploy #733: Commit 67af4cc pushed by SiebeLeDe
June 28, 2024 08:09 57s SI-maker-redesign
SI-maker-redesign
June 28, 2024 08:09 57s
Does not work well. It prints the whole results object. I want to pri… Documentation-no-Deploy #732: Commit 39cb9d1 pushed by SiebeLeDe
June 27, 2024 20:21 1m 0s SI-maker-redesign
SI-maker-redesign
June 27, 2024 20:21 1m 0s
Does not work well. It prints the whole results object. I want to pri… Testing #1010: Commit 39cb9d1 pushed by SiebeLeDe
June 27, 2024 20:21 1m 0s SI-maker-redesign
SI-maker-redesign
June 27, 2024 20:21 1m 0s
added a checker if the calculation is suitable for a xyz writer Testing #1009: Commit 939bbd7 pushed by SiebeLeDe
June 27, 2024 19:33 55s SI-maker-redesign
SI-maker-redesign
June 27, 2024 19:33 55s
added a checker if the calculation is suitable for a xyz writer Documentation-no-Deploy #731: Commit 939bbd7 pushed by SiebeLeDe
June 27, 2024 19:33 56s SI-maker-redesign
SI-maker-redesign
June 27, 2024 19:33 56s
Simplified the SI writer for coordinates Documentation-no-Deploy #730: Commit 70e39c7 pushed by SiebeLeDe
June 27, 2024 19:31 55s SI-maker-redesign
SI-maker-redesign
June 27, 2024 19:31 55s
Simplified the SI writer for coordinates Testing #1008: Commit 70e39c7 pushed by SiebeLeDe
June 27, 2024 19:31 54s SI-maker-redesign
SI-maker-redesign
June 27, 2024 19:31 54s
Python API for IRC concatenation Testing #1007: Commit d30f0e3 pushed by SiebeLeDe
June 27, 2024 18:51 1m 35s 256-irc-api
256-irc-api
June 27, 2024 18:51 1m 35s
Python API for IRC concatenation Documentation-no-Deploy #729: Commit d30f0e3 pushed by SiebeLeDe
June 27, 2024 18:51 1m 1s 256-irc-api
256-irc-api
June 27, 2024 18:51 1m 1s
Added the connect module with default connections to Bazis and Snellius Testing #1006: Commit 3ddeda3 pushed by YHordijk
June 26, 2024 21:38 50s 273-new-module-for-connecting-to-remote-servers
273-new-module-for-connecting-to-remote-servers
June 26, 2024 21:38 50s