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12 Open 25 Closed
12 Open 25 Closed
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Issues list

Parser fails for output from unrestricted EOM-CCSD
#71 opened Mar 15, 2023 by danielhollas
aiida-orca version not updated in aiida plugin registry documentation Improvements or additions to documentation
#70 opened Feb 20, 2023 by danielhollas
Do not always fetch gbw files to local folder enhancement New feature or request
#68 opened Feb 16, 2023 by danielhollas
1
@danielhollas
Increase test coverage tests
#64 opened Feb 10, 2023 by danielhollas
4
Figure out if extra_input_keywords serve any purpose question Further information is requested
#63 opened Feb 10, 2023 by danielhollas v1.0.0
Support global %maxcore option in the input file generation
#45 opened Oct 24, 2022 by danielhollas
2
Units of excited state energies
#28 opened Jul 9, 2021 by danielhollas
1
Data class for spectra enhancement New feature or request
#22 opened Mar 22, 2020 by ezpzbz v1.0.0
@ezpzbz
1
Adding examples exploiting different types of basis sets enhancement New feature or request
#19 opened Mar 18, 2020 by ezpzbz v0.6.0
@ezpzbz
Convert GBW to WFN enhancement New feature or request
#18 opened Mar 18, 2020 by ezpzbz v0.9.0
@ezpzbz
Implementing workchains enhancement New feature or request
#16 opened Mar 18, 2020 by ezpzbz
2 tasks
v1.0.0
@ezpzbz
Input parameter validation enhancement New feature or request
#4 opened Mar 13, 2020 by ezpzbz
5 tasks
v1.0.0
@ezpzbz
1
ProTip! no:milestone will show everything without a milestone.