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update doc
tests #755: Commit 5a011f5 pushed by qzhu2017
April 21, 2024 00:39 4m 48s v0.6.5
April 21, 2024 00:39 4m 48s
add site symmetry doc
tests #754: Commit 554c51f pushed by qzhu2017
April 21, 2024 00:25 4m 15s master
April 21, 2024 00:25 4m 15s
finish the site symmetry notation and representation #249
tests #753: Commit 70d7727 pushed by qzhu2017
April 20, 2024 19:16 4m 11s master
April 20, 2024 19:16 4m 11s
April 20, 2024 03:36 4m 2s
debug site symmetry and 1d-rep function
tests #751: Commit 4749705 pushed by qzhu2017
April 18, 2024 01:54 4m 11s master
April 18, 2024 01:54 4m 11s
to fix the site symmetry symbol #249
tests #750: Commit 7c1d092 pushed by qzhu2017
April 17, 2024 18:25 4m 29s master
April 17, 2024 18:25 4m 29s
fix typo for Cl-
tests #749: Commit 3721971 pushed by qzhu2017
April 8, 2024 23:25 4m 11s master
April 8, 2024 23:25 4m 11s
add fix for molecule
tests #748: Commit 215a025 pushed by qzhu2017
April 8, 2024 16:11 4m 19s master
April 8, 2024 16:11 4m 19s
update the single smiles string
tests #747: Commit 4eb317c pushed by qzhu2017
April 8, 2024 14:51 5m 29s master
April 8, 2024 14:51 5m 29s
fix reading Cl-
tests #746: Commit f37e24b pushed by qzhu2017
April 8, 2024 01:05 4m 9s master
April 8, 2024 01:05 4m 9s
add documentation for db
tests #745: Commit 2ccde5f pushed by qzhu2017
April 6, 2024 17:53 4m 15s master
April 6, 2024 17:53 4m 15s
add a function to check if the molecule has a cyclic ring
tests #744: Commit e58af6c pushed by qzhu2017
March 25, 2024 17:13 4m 12s master
March 25, 2024 17:13 4m 12s
update to v0.6.4
tests #743: Commit 4713688 pushed by qzhu2017
March 18, 2024 23:58 4m 18s v0.6.4
March 18, 2024 23:58 4m 18s
update to v0.6.4
tests #742: Commit 4713688 pushed by qzhu2017
March 18, 2024 23:51 4m 17s master
March 18, 2024 23:51 4m 17s
Merge pull request #248 from kyledmiller/master
tests #741: Commit 4e457fb pushed by qzhu2017
March 18, 2024 23:43 4m 14s master
March 18, 2024 23:43 4m 14s
update req
tests #739: Commit 0196a58 pushed by qzhu2017
March 16, 2024 15:13 4m 23s master
March 16, 2024 15:13 4m 23s
update pymatgen to remove ci error
tests #738: Commit 4cc67c4 pushed by qzhu2017
March 16, 2024 15:07 20s master
March 16, 2024 15:07 20s
output splitter for get_transition function
tests #737: Commit 11630be pushed by qzhu2017
March 16, 2024 00:55 3m 12s master
March 16, 2024 00:55 3m 12s
add new_struc util
tests #736: Commit 789b702 pushed by qzhu2017
March 2, 2024 23:55 3m 11s master
March 2, 2024 23:55 3m 11s
fix from_file error
tests #735: Commit cab048d pushed by qzhu2017
March 2, 2024 23:11 3m 27s master
March 2, 2024 23:11 3m 27s
fix the issue of representation.from_string
tests #734: Commit acf2c65 pushed by qzhu2017
March 2, 2024 17:13 3m 13s master
March 2, 2024 17:13 3m 13s
Resolve fails for some structures #246
tests #733: Commit e489ebb pushed by qzhu2017
February 27, 2024 23:21 4m 49s master
February 27, 2024 23:21 4m 49s
fix the bug due to wp
tests #732: Commit 9fcb247 pushed by qzhu2017
February 23, 2024 18:45 4m 48s master
February 23, 2024 18:45 4m 48s
fix the typo of numWp
tests #731: Commit 0e013bb pushed by qzhu2017
February 23, 2024 18:30 4m 30s master
February 23, 2024 18:30 4m 30s
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