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BUG: Fixed crash when searching for new K, alpha when no value yet
.github/workflows/paper.yml #48: Commit 1d036e9 pushed by Fraser-Birks
September 26, 2023 14:49 58s ParallelNCFlex
September 26, 2023 14:49 58s
BUG: Fixed bug to ensure correct behaviour of alpha period finder wh…
.github/workflows/paper.yml #47: Commit a4eae34 pushed by Fraser-Birks
September 26, 2023 13:45 1m 7s ParallelNCFlex
September 26, 2023 13:45 1m 7s
WIP: Added debugging print statements for alpha_range
.github/workflows/paper.yml #46: Commit c5ba684 pushed by Fraser-Birks
September 26, 2023 11:20 56s ParallelNCFlex
September 26, 2023 11:20 56s
BUG: Changed default of cb to not be None due to errors with parameter
.github/workflows/paper.yml #45: Commit 10aa552 pushed by Fraser-Birks
September 26, 2023 11:10 58s ParallelNCFlex
September 26, 2023 11:10 58s
Merge pull request #162 from libAtoms/adaptivecont
.github/workflows/paper.yml #44: Commit 6e529f1 pushed by jameskermode
September 25, 2023 13:08 58s master
September 25, 2023 13:08 58s
Merge branch 'adaptivecont' into ParallelNCFlex
.github/workflows/paper.yml #43: Commit 83b5621 pushed by Fraser-Birks
September 24, 2023 12:32 51s ParallelNCFlex
September 24, 2023 12:32 51s
WIP: Added kill confirm queue for parallelism
.github/workflows/paper.yml #42: Commit 541b904 pushed by Fraser-Birks
September 24, 2023 12:19 52s ParallelNCFlex
September 24, 2023 12:19 52s
WIP: Added parallel NCFlex script
.github/workflows/paper.yml #41: Commit fd773bd pushed by Fraser-Birks
September 24, 2023 12:18 54s ParallelNCFlex
September 24, 2023 12:18 54s
Merge branch 'master' into ParallelNCFlex
.github/workflows/paper.yml #40: Commit 7241aad pushed by Fraser-Birks
September 23, 2023 12:10 53s ParallelNCFlex
September 23, 2023 12:10 53s
WIP: Improved preconditioning, added shift gradients, added parallel
.github/workflows/paper.yml #39: Commit 8c1dbea pushed by Fraser-Birks
September 23, 2023 12:09 53s ParallelNCFlex
September 23, 2023 12:09 53s
Merge pull request #181 from computerscienceiscool/patch-1
.github/workflows/paper.yml #38: Commit dbc5d14 pushed by jameskermode
September 17, 2023 13:43 52s master
September 17, 2023 13:43 52s
Merge pull request #180 from thomas-rocke/TR-Paper-Contrib
.github/workflows/paper.yml #37: Commit 4213667 pushed by jameskermode
September 7, 2023 16:39 1m 6s master
September 7, 2023 16:39 1m 6s
Merge pull request #179 from thomas-rocke/TR-Paper-Contrib
.github/workflows/paper.yml #36: Commit f135288 pushed by jameskermode
September 7, 2023 16:24 1m 11s master
September 7, 2023 16:24 1m 11s
DOC: Moved OPLS module examples to Jupyter notebook.
.github/workflows/paper.yml #35: Commit 9f7fe9e pushed by aklemenz
August 31, 2023 16:28 55s 23-opls-doc
August 31, 2023 16:28 55s
Merge pull request #174 from thomas-rocke/elastic-constants-assumed-err
.github/workflows/paper.yml #34: Commit 9d1254f pushed by jameskermode
August 23, 2023 10:47 59s master
August 23, 2023 10:47 59s
Merge pull request #175 from thomas-rocke/committee-acehal-compatibility
.github/workflows/paper.yml #33: Commit 75c2222 pushed by jameskermode
August 23, 2023 10:45 58s master
August 23, 2023 10:45 58s
code feedback corrections
.github/workflows/paper.yml #31: Commit 91c866e pushed by lakshenoy
August 15, 2023 15:38 1m 0s adaptivecont
August 15, 2023 15:38 1m 0s
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