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Added a module for working with RMG reaction families
Labeler #1588: Pull request #754 synchronize by alongd
January 12, 2025 07:53 10s reaction_families
January 12, 2025 07:53 10s
Added a module for working with RMG reaction families
Labeler #1587: Pull request #754 synchronize by alongd
January 12, 2025 07:49 10s reaction_families
January 12, 2025 07:49 10s
Added a module for working with RMG reaction families
Labeler #1586: Pull request #754 synchronize by alongd
January 8, 2025 21:32 12s reaction_families
January 8, 2025 21:32 12s
Added a module for working with RMG reaction families
Labeler #1585: Pull request #754 synchronize by alongd
January 8, 2025 16:25 11s reaction_families
January 8, 2025 16:25 11s
Added a module for working with RMG reaction families
Labeler #1584: Pull request #754 synchronize by alongd
January 8, 2025 14:56 14s reaction_families
January 8, 2025 14:56 14s
Added a module for working with RMG reaction families
Labeler #1583: Pull request #754 synchronize by alongd
January 8, 2025 06:59 11s reaction_families
January 8, 2025 06:59 11s
Added a module for working with RMG reaction families
Labeler #1582: Pull request #754 synchronize by alongd
January 5, 2025 19:06 12s reaction_families
January 5, 2025 19:06 12s
Added a module for working with RMG reaction families
Labeler #1581: Pull request #754 synchronize by alongd
January 5, 2025 15:23 16s reaction_families
January 5, 2025 15:23 16s
Added a module for working with RMG reaction families
Labeler #1580: Pull request #754 synchronize by alongd
January 5, 2025 15:04 10s reaction_families
January 5, 2025 15:04 10s
Fix the normal mode displacement TS check
Labeler #1579: Pull request #768 synchronize by alongd
January 5, 2025 15:04 15s nmd
nmd
January 5, 2025 15:04 15s
Fix the normal mode displacement TS check
Labeler #1578: Pull request #768 synchronize by alongd
January 5, 2025 11:24 12s nmd
nmd
January 5, 2025 11:24 12s
Added a module for working with RMG reaction families
Labeler #1577: Pull request #754 synchronize by alongd
January 5, 2025 07:29 16s reaction_families
January 5, 2025 07:29 16s
Zmat params
Labeler #1576: Pull request #780 synchronize by alongd
January 2, 2025 20:44 11s zmat_params
January 2, 2025 20:44 11s
Zmat params
Labeler #1575: Pull request #780 synchronize by LeenFahoum
January 1, 2025 08:52 14s zmat_params
January 1, 2025 08:52 14s
Zmat params
Labeler #1574: Pull request #780 synchronize by LeenFahoum
January 1, 2025 07:45 10s zmat_params
January 1, 2025 07:45 10s
Zmat params
Labeler #1573: Pull request #780 synchronize by alongd
December 31, 2024 08:09 23s zmat_params
December 31, 2024 08:09 23s
Zmat params
Labeler #1572: Pull request #780 synchronize by alongd
December 30, 2024 15:46 11s zmat_params
December 30, 2024 15:46 11s
Update environment.yml to replace rmg::symmetry with connie::symmetry
Labeler #1571: Pull request #781 synchronize by calvinp0
December 30, 2024 14:20 14s zeus_symm
December 30, 2024 14:20 14s
Update environment.yml to replace rmg::symmetry with connie::symmetry
Labeler #1570: Pull request #781 opened by calvinp0
December 30, 2024 14:20 14s zeus_symm
December 30, 2024 14:20 14s
Zmat params
Labeler #1569: Pull request #780 opened by alongd
December 30, 2024 12:33 14s zmat_params
December 30, 2024 12:33 14s
Adapt parse_nd_scan_energies() to a slightly different Gaussian 2D scan format
Labeler #1568: Pull request #777 synchronize by alongd
December 29, 2024 10:19 16s 2dsfix
December 29, 2024 10:19 16s
Added a module for working with RMG reaction families
Labeler #1567: Pull request #754 synchronize by alongd
December 28, 2024 19:15 15s reaction_families
December 28, 2024 19:15 15s
Added a module for working with RMG reaction families
Labeler #1566: Pull request #754 synchronize by alongd
December 21, 2024 20:09 11s reaction_families
December 21, 2024 20:09 11s
Added a module for working with RMG reaction families
Labeler #1565: Pull request #754 synchronize by alongd
December 21, 2024 10:42 10s reaction_families
December 21, 2024 10:42 10s
Added a module for working with RMG reaction families
Labeler #1564: Pull request #754 synchronize by alongd
December 20, 2024 12:15 16s reaction_families
December 20, 2024 12:15 16s