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5 Open 3 Closed
5 Open 3 Closed
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Issues list

PBEh-3c as unknown functional casues basis set not to be parsed (software gaussian) bug Something isn't working
#15 opened Jul 1, 2023 by zarkoivkovicc
1
Fix the use of the basis set LANL2DZ with heavy atoms in ORCA bug Something isn't working good first issue Good for newcomers
#13 opened Jun 23, 2023 by RaphaelRobidas
Support TD-DFT calculations in ORCA enhancement Improvement of existing features
#7 opened Mar 26, 2023 by RaphaelRobidas
Support for IRC calculations enhancement Improvement of existing features good first issue Good for newcomers
#6 opened Mar 26, 2023 by RaphaelRobidas
Add the "TSFREQ" calculation type good first issue Good for newcomers
#2 opened Feb 12, 2023 by RaphaelRobidas
ProTip! What’s not been updated in a month: updated:<2024-11-13.