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aiidateam
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aiida-pseudo
MIT License
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Devops: Make use of the improved fixtures in `aiida-core`
#171
sphuber
opened
3 months ago
0
Docs: Explicitly state that AiiDA's `Group` API and CLI can be used
#170
sphuber
closed
5 months ago
0
Pre-commit: Switch to `ruff` for linting and formatting
#169
sphuber
closed
6 months ago
0
Hashing made with element and md5 checksum
#168
unkcpz
closed
6 months ago
7
Ignore version and filename when compute hash for the pseudo node
#167
unkcpz
closed
6 months ago
6
CLI: Enable install `--download-only` without available profile
#166
sphuber
closed
8 months ago
3
Install with --download-only require a valid AiiDA profile
#165
unkcpz
closed
8 months ago
0
Release `v1.3.0`
#164
sphuber
closed
8 months ago
0
Docs: Add more information on migrating from legacy `aiida-core`
#163
sphuber
closed
9 months ago
0
Dependencies: Update requirements of `docs` extra
#162
sphuber
closed
9 months ago
0
Docs: Add how to migrate from legacy UPF family
#161
sphuber
closed
9 months ago
1
Docs: Improve section on installing custom archive
#160
sphuber
closed
9 months ago
1
Devops: Add continuous-deployment workflow
#159
sphuber
closed
10 months ago
0
❓Rename default branch to `main`?
#158
mbercx
closed
10 months ago
2
Backport of support for SSSP v1.3 and PseudoDojo v0.5
#157
sphuber
closed
10 months ago
0
Add backport for SSSP v1.3 and Pseudo-Dojo v0.5
#156
mbercx
closed
10 months ago
1
Add support for Pseudo-dojo v0.5
#155
mbercx
closed
10 months ago
0
Add support for Pseudo-dojo v0.5 (PBE only)
#154
mbercx
closed
10 months ago
1
Adding SSSP 1.3.0 support
#153
unkcpz
closed
1 year ago
8
CLI: Change `Critical` to `Report` if family exists in `install` command
#152
sphuber
closed
1 year ago
0
DevOps: Update compatibility matrix in `README.md`
#151
sphuber
closed
1 year ago
0
DevOps: Update Python version and `setup-python` action in CI/CD
#150
sphuber
closed
1 year ago
0
`aiida-pseudo install` should not return `Critical` if family already installed
#149
ltalirz
closed
1 year ago
0
Release `v1.0.0`
#148
sphuber
closed
1 year ago
1
`RecommendedCutoffMixin`: Remove workaround for stringency units
#147
sphuber
closed
1 year ago
0
Decouple the maintenance of pseudo libraries version from the release
#146
unkcpz
closed
1 year ago
13
Release `v0.9.0`
#145
mbercx
closed
1 year ago
0
Add support for SSSP v1.2
#144
mbercx
closed
1 year ago
4
Release `v0.8.0`
#143
sphuber
closed
1 year ago
0
CLI: Reduce the load time significantly
#142
sphuber
closed
1 year ago
0
Improve the load time of the `aiida-pseudo` CLI
#141
sphuber
closed
1 year ago
0
Docs: Update the compatibility matrix
#140
sphuber
closed
1 year ago
0
Dependencies: Add support for Python 3.11
#139
sphuber
closed
1 year ago
0
DevOps: Address test warnings
#138
sphuber
closed
1 year ago
0
DevOps: Update dependency `pylint==2.15.5`
#137
sphuber
closed
1 year ago
0
CLI: update to be compatible with `aiida-core==2.1`
#136
sphuber
closed
1 year ago
0
CLI: add install `--from-download` for sssp and pseudo-dojo
#135
mbercx
closed
10 months ago
12
CLI: block family cutoffs set for established families
#134
mbercx
closed
1 year ago
1
Docs: Add acknowledgements
#133
mbercx
closed
1 year ago
0
CLI: filter cutoffs from JSON file for family cutoffs set
#132
mbercx
closed
1 year ago
2
Problem with "aiida-pseudo install sssp"
#131
SangbumYi
closed
1 year ago
2
CLI broken when installed with `aiida-core==2.1`
#130
sphuber
closed
1 year ago
2
Docs: remove manual addition of package to `sys.path`
#129
sphuber
closed
2 years ago
0
Refactor: remove use of `os.path` in favor of `pathlib`
#128
sphuber
closed
2 years ago
0
Refactor: replace `tmpdir` fixture with `tmp_path`
#127
sphuber
closed
2 years ago
0
Refactor: remove use of deprecated `distutils` module
#126
sphuber
closed
2 years ago
0
`PsmlData`: Add parsing of Z-valence from file
#125
sphuber
closed
2 years ago
0
DevOps: Update all `pre-commit` dependencies
#124
sphuber
closed
2 years ago
0
Devops: add GitHub Actions workflow for continuous deployment
#123
sphuber
closed
2 years ago
0
DevOps: Add compatibility matrix `README.md`
#122
sphuber
closed
2 years ago
0
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