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Pull requests: JuDFTteam/aiida-kkr

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Pull requests list

Update masci-tools requirement from ^0.3.12.dev5 to >=0.3.12,<0.5.0 dependencies Pull requests that update a dependency file
#58 by dependabot-preview bot was closed Apr 29, 2021 Loading…
1
Allowing SGE schedulers to use the plugin
#41 by JPchico was merged Dec 8, 2020 Loading…
9
Add files via upload
#44 by RubelMozumder was closed Dec 2, 2020 Loading…
Bandstructure wf
#45 by RubelMozumder was merged Dec 18, 2020 Loading…
28
Bandstructure wf
#47 by RubelMozumder was merged Dec 18, 2020 Loading…
Revert "Bandstructure wf"
#48 by RubelMozumder was closed Dec 18, 2020 Loading…
Revert 47 bandstructure wf
#49 by RubelMozumder was closed Dec 18, 2020 Loading…
Revert "Bandstructure wf"
#51 by RubelMozumder was closed Jan 4, 2021 Loading…
Implement a switch to not retrieve kkrflex_green and tmat files and improve plot_kkr enhancement
#52 by PhilippRue was merged Jan 14, 2021 Loading…
@PhilippRue
3
finish bandstructure workflow implementation
#53 by PhilippRue was merged Jan 6, 2021 Loading…
2 tasks done
Bandstructure wf
#54 by RubelMozumder was merged Jan 8, 2021 Loading…
Update calculations.rst
#56 by RubelMozumder was closed Feb 3, 2021 Loading…
1
Implement aiida-kkr cli
#37 by broeder-j was closed Nov 23, 2020 Loading…
removing deprecated plugins aiida.work
#57 by RubelMozumder was merged May 10, 2021 Loading…
Combined impurity wf
#60 by RubelMozumder was merged Jul 19, 2022 Loading…
1
Modifying the EOS workchain so that i works with alloys
#62 by JPchico was merged Apr 29, 2021 Loading…
1
Fix for issue #64
#65 by PhilippRue was merged May 10, 2021 Loading…
1
Upgrade to GitHub-native Dependabot dependencies Pull requests that update a dependency file
#66 by dependabot-preview bot was merged May 5, 2021 Loading…
Update masci-tools requirement from ^0.3.12.dev5 to >=0.3.12,<0.5.0 dependencies Pull requests that update a dependency file
#67 by dependabot bot was merged May 7, 2021 Loading…
Bandstructure wf
#68 by RubelMozumder was closed May 10, 2021 Loading…
small bug fixing and small edit
#70 by RubelMozumder was merged May 11, 2021 Loading…
1
Add functionality for BdG calculations
#72 by PhilippRue was merged Jul 21, 2022 Loading…
12
Update sqlalchemy requirement from <1.4.0 to <1.5.0 dependencies Pull requests that update a dependency file
#73 by dependabot bot was closed Jul 14, 2022 Loading…
1
Update frozendict requirement from <2.0 to <3.0 dependencies Pull requests that update a dependency file
#74 by dependabot bot was closed Jul 14, 2022 Loading…
2
Bugfix combine imps workflow after update to aiida v2
#155 by PhilippRue was merged May 29, 2024 Loading…
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