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Accommodate user incar settings in amorphous flow testing #91: Commit fd6aed1 pushed by mcgalcode
February 28, 2024 23:09 3m 13s feature/vasp-converge
feature/vasp-converge
February 28, 2024 23:09 3m 13s
Adapt step_size and buffer length to trajectory length testing #90: Commit e628e10 pushed by mcgalcode
February 14, 2024 23:11 2m 56s feature/vasp-converge
feature/vasp-converge
February 14, 2024 23:11 2m 56s
update the name testing #89: Commit 9a84869 pushed by Tinaatucsd
December 19, 2023 05:38 4m 20s bugfix/refactor-pv-extract
bugfix/refactor-pv-extract
December 19, 2023 05:38 4m 20s
Add scale_factor_increment as parameter to md flow testing #88: Commit 15ef553 pushed by mcgalcode
August 23, 2023 20:56 3m 19s feature/vasp-converge
feature/vasp-converge
August 23, 2023 20:56 3m 19s
remove m3gnet requirement testing #87: Commit ebf5331 pushed by mcgalcode
August 22, 2023 23:08 3m 19s feature/vasp-converge
feature/vasp-converge
August 22, 2023 23:08 3m 19s
allow more equilibration search steps testing #86: Commit 065408a pushed by mcgalcode
July 28, 2023 05:06 3m 51s feature/vasp-converge
feature/vasp-converge
July 28, 2023 05:06 3m 51s
Choose lowest energy frames testing #85: Commit 2d732df pushed by mcgalcode
July 27, 2023 21:29 3m 43s feature/vasp-converge
feature/vasp-converge
July 27, 2023 21:29 3m 43s
fix typo testing #84: Commit 050ba84 pushed by mcgalcode
July 24, 2023 15:53 3m 22s feature/vasp-converge
feature/vasp-converge
July 24, 2023 15:53 3m 22s
fix typo testing #83: Commit 3f6e076 pushed by mcgalcode
July 24, 2023 15:51 3m 57s feature/vasp-converge
feature/vasp-converge
July 24, 2023 15:51 3m 57s
Improve converge flow by not storing ecxtra MD outputs testing #82: Commit f259b43 pushed by mcgalcode
July 24, 2023 15:49 3m 55s feature/vasp-converge
feature/vasp-converge
July 24, 2023 15:49 3m 55s
fix typo testing #81: Commit 9efae7c pushed by mcgalcode
July 21, 2023 23:38 3m 18s feature/vasp-converge
feature/vasp-converge
July 21, 2023 23:38 3m 18s
Fixes testing #80: Commit 5fb478d pushed by mcgalcode
July 21, 2023 23:35 3m 18s feature/vasp-converge
feature/vasp-converge
July 21, 2023 23:35 3m 18s
fix typo testing #79: Commit 1500795 pushed by mcgalcode
July 21, 2023 22:21 3m 26s feature/vasp-converge
feature/vasp-converge
July 21, 2023 22:21 3m 26s
Fix bug testing #78: Commit 2564e01 pushed by mcgalcode
July 21, 2023 22:20 3m 14s feature/vasp-converge
feature/vasp-converge
July 21, 2023 22:20 3m 14s
fix bug testing #77: Commit 0327ed7 pushed by mcgalcode
July 21, 2023 21:54 3m 11s feature/vasp-converge
feature/vasp-converge
July 21, 2023 21:54 3m 11s
Fix bug in equilibrate vol job testing #76: Commit 6a064bc pushed by mcgalcode
July 20, 2023 23:40 3m 20s feature/vasp-converge
feature/vasp-converge
July 20, 2023 23:40 3m 20s
Allow uer inputs for vasp flow testing #75: Commit d871bf7 pushed by mcgalcode
July 20, 2023 23:05 3m 12s feature/vasp-converge
feature/vasp-converge
July 20, 2023 23:05 3m 12s
Update INcar tags testing #74: Commit 17a7241 pushed by mcgalcode
July 19, 2023 20:06 4m 7s feature/vasp-converge
feature/vasp-converge
July 19, 2023 20:06 4m 7s
fix typo testing #73: Commit 9c75644 pushed by mcgalcode
July 17, 2023 19:05 3m 53s feature/vasp-converge
feature/vasp-converge
July 17, 2023 19:05 3m 53s
fix typo testing #72: Commit 64dfa6b pushed by mcgalcode
July 17, 2023 18:58 3m 8s feature/vasp-converge
feature/vasp-converge
July 17, 2023 18:58 3m 8s
Start amorphous workflow testing #71: Commit e4570a9 pushed by mcgalcode
July 17, 2023 18:55 3m 15s feature/vasp-converge
feature/vasp-converge
July 17, 2023 18:55 3m 15s