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aiidalab
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aiidalab-qe
AiiDAlab App for Quantum ESPRESSO
https://aiidalab-qe.readthedocs.io/
MIT License
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Bump version v24.04.0rc2 -> v24.04.0rc3
#714
superstar54
closed
2 months ago
5
Handle plugin gracefully
#713
superstar54
closed
2 months ago
2
Bump AWB from 2.2.0a0 to 2.2.0
#712
superstar54
closed
2 months ago
0
fix code for xps, xas, and update the code resources
#711
superstar54
closed
2 months ago
1
Fix current year in app
#710
AndresOrtegaGuerrero
closed
2 months ago
0
Controlling the walltime of calculations
#709
AndresOrtegaGuerrero
closed
1 month ago
3
Feature Spin-Orbit coupling
#708
AndresOrtegaGuerrero
closed
1 month ago
1
Bump version v24.04.0rc1 -> v24.04.0rc2
#707
superstar54
closed
2 months ago
0
use python script to setup all codes
#706
superstar54
closed
2 months ago
5
udpate page footer
#705
superstar54
closed
2 months ago
1
fix setting default codes
#704
superstar54
closed
2 months ago
0
fix plugin.yaml file url
#703
superstar54
closed
2 months ago
0
fix structures
#702
superstar54
closed
2 months ago
6
Bump version v24.04.0rc1 -> v24.04.0rc2
#701
superstar54
closed
2 months ago
1
restart the daemon with --reset flag manually
#700
superstar54
closed
2 months ago
0
Feature: Converge Thresholds
#699
AndresOrtegaGuerrero
closed
2 months ago
5
Codes are not automatically selected
#698
unkcpz
closed
2 months ago
0
Bump version v24.04.0rc0 -> v24.04.0rc1
#697
superstar54
closed
2 months ago
0
Plugin management page only show the first author
#696
superstar54
closed
2 months ago
0
use python API to setup code
#695
superstar54
closed
2 months ago
5
incease timeout to 300
#694
superstar54
closed
2 months ago
0
Code setup fail
#693
superstar54
closed
2 months ago
0
Initialize empty columns for an empty DataFrame
#692
superstar54
closed
2 months ago
0
Job list page error if there is not jobs
#691
superstar54
closed
2 months ago
0
Add Wannier plugin
#690
superstar54
opened
2 months ago
1
Add SOC to the core
#689
superstar54
closed
1 month ago
0
Add bumpver pre-commit
#688
danielhollas
closed
2 months ago
3
Bump version v24.04.0a3 -> v24.04.0rc0
#687
superstar54
closed
2 months ago
4
Bump certifi from 2023.5.7 to 2023.7.22 in /docs
#686
dependabot[bot]
opened
2 months ago
0
Bump the gha-dependencies group with 5 updates
#685
dependabot[bot]
closed
2 days ago
1
Bump urllib3 from 2.0.3 to 2.0.7 in /docs
#684
dependabot[bot]
opened
2 months ago
1
Fix reminder_text
#683
superstar54
closed
2 months ago
0
Use `options` to set the `resources` of the builder
#682
superstar54
opened
2 months ago
0
add waiting state
#681
superstar54
closed
2 months ago
1
Docs: How to search for jobs
#680
superstar54
opened
2 months ago
1
Rearrange the home page logo and Utils text
#679
superstar54
opened
2 months ago
0
Add `running` state in job search page
#678
superstar54
closed
2 months ago
0
Add support for charge density
#677
superstar54
opened
2 months ago
0
add blogs section and release_202404
#676
superstar54
closed
1 month ago
3
Show result panel immediately when available.
#675
superstar54
closed
2 months ago
0
bump aiida-quantumespresso from 4.4 to 4.6
#674
superstar54
closed
2 months ago
0
Allow user to edit the builder before submit.
#673
superstar54
opened
2 months ago
0
Bump idna from 3.4 to 3.7 in /docs
#672
dependabot[bot]
opened
2 months ago
0
Support group jobs
#671
superstar54
opened
2 months ago
0
add label and description for the job
#670
superstar54
closed
2 months ago
0
check if the code is installed and usable
#669
superstar54
closed
2 months ago
0
assgin clean_workdir to plugin's builder
#667
superstar54
closed
2 months ago
4
`clean_workdir` failed for plugins
#666
superstar54
closed
2 months ago
0
Export / Import Buttons (Sharing Data within QeApp)
#665
AndresOrtegaGuerrero
opened
2 months ago
0
Sharing Results from aiidalab_qe between users
#664
AndresOrtegaGuerrero
closed
2 months ago
2
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