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Debugging Python Package using Conda #446: Commit 3fab7ca pushed by choglass
January 8, 2025 08:48 2m 5s dev_update
dev_update
January 8, 2025 08:48 2m 5s
Fix error in charge assignment and spin Python Package using Conda #445: Commit e035d31 pushed by choglass
January 7, 2025 19:52 2m 10s dev_update
dev_update
January 7, 2025 19:52 2m 10s
Update get_metal_poscharges Python Package using Conda #444: Commit 6eecc9d pushed by choglass
January 7, 2025 18:19 2m 11s dev_update
dev_update
January 7, 2025 18:19 2m 11s
Fix IndexError from non_local_groups Python Package using Conda #443: Commit 479542b pushed by choglass
January 5, 2025 20:55 2m 7s dev_update
dev_update
January 5, 2025 20:55 2m 7s
Debugging Python Package using Conda #442: Commit 75e470f pushed by choglass
January 4, 2025 22:49 2m 0s dev_update
dev_update
January 4, 2025 22:49 2m 0s
Reset Adjacency Matrix for alkali and alkaline earth metals Python Package using Conda #441: Commit abf8779 pushed by choglass
January 4, 2025 22:22 2m 11s dev_update
dev_update
January 4, 2025 22:22 2m 11s
get_unique_species_in_reference test Python Package using Conda #440: Commit 6a9905e pushed by choglass
January 3, 2025 11:33 2m 15s dev_update
dev_update
January 3, 2025 11:33 2m 15s
Debugging coordination_correction_for_nonhaptic Python Package using Conda #439: Commit bc12822 pushed by choglass
January 3, 2025 00:03 2m 11s dev_update
dev_update
January 3, 2025 00:03 2m 11s
Debugging get_coordination_geometry Python Package using Conda #438: Commit 253c2ff pushed by choglass
January 2, 2025 14:16 2m 10s dev_update
dev_update
January 2, 2025 14:16 2m 10s
handling error exit_with_error_exception Python Package using Conda #437: Commit b124483 pushed by choglass
December 31, 2024 11:58 2m 8s dev_update
dev_update
December 31, 2024 11:58 2m 8s
Update balance_charge by including metal OS prediction model for Fe Python Package using Conda #436: Commit 2c899a9 pushed by choglass
November 17, 2024 20:26 2m 7s dev_update
dev_update
November 17, 2024 20:26 2m 7s
Debugging Python Package using Conda #435: Commit 2c4a76b pushed by choglass
November 17, 2024 17:18 2m 10s dev_update
dev_update
November 17, 2024 17:18 2m 10s
Fix error in prefilter_cif Python Package using Conda #434: Commit be3bcf5 pushed by choglass
November 17, 2024 12:01 2m 10s dev_update
dev_update
November 17, 2024 12:01 2m 10s
Update jupyter notebook for manual check Python Package using Conda #433: Commit ab3d1b7 pushed by choglass
November 14, 2024 23:20 2m 9s dev_update
dev_update
November 14, 2024 23:20 2m 9s
Debugging ASSIGN_CHARGES and generate error_input.out Python Package using Conda #432: Commit b131b28 pushed by choglass
November 14, 2024 23:13 2m 9s dev_update
dev_update
November 14, 2024 23:13 2m 9s
Refine AC2BO in xyz2mol Python Package using Conda #431: Commit 23f4b09 pushed by choglass
November 14, 2024 16:21 2m 0s dev_update
dev_update
November 14, 2024 16:21 2m 0s
Debugging split_group in coordination_sphere Python Package using Conda #430: Commit 0b1763d pushed by choglass
November 14, 2024 13:01 2m 19s dev_update
dev_update
November 14, 2024 13:01 2m 19s
Debugging UnboundLocalError in process_unitcell Python Package using Conda #429: Commit e12b742 pushed by choglass
November 13, 2024 17:42 2m 8s dev_update
dev_update
November 13, 2024 17:42 2m 8s
Debugging create_bonds_specie with Deuterium Python Package using Conda #428: Commit 12e0c97 pushed by choglass
November 13, 2024 17:24 2m 9s dev_update
dev_update
November 13, 2024 17:24 2m 9s
Debugging KeyError for water missing H and for Deuterium Python Package using Conda #427: Commit 57f53b6 pushed by choglass
November 13, 2024 16:58 2m 4s dev_update
dev_update
November 13, 2024 16:58 2m 4s
Update jupyter notebook for checking cell object Python Package using Conda #426: Commit 2ec3135 pushed by choglass
November 11, 2024 12:42 2m 11s dev_update
dev_update
November 11, 2024 12:42 2m 11s
Debugging evaluate_as_nitrosyl and assign_charges Python Package using Conda #425: Commit 7397a04 pushed by choglass
November 10, 2024 17:49 2m 13s dev_update
dev_update
November 10, 2024 17:49 2m 13s
Add final_c2m_driver and modify codes accordingly Python Package using Conda #424: Commit 669856d pushed by choglass
November 9, 2024 10:25 2m 8s dev_update
dev_update
November 9, 2024 10:25 2m 8s
Minor updates Python Package using Conda #423: Commit 13c1399 pushed by choglass
July 1, 2024 15:05 5m 12s dev
dev
July 1, 2024 15:05 5m 12s
Fix error getting radii in getconec Python Package using Conda #422: Commit 22473bb pushed by choglass
June 5, 2024 11:57 4m 56s dev
dev
June 5, 2024 11:57 4m 56s