aiida-alloy

Aiida Workflows for Elastic Constants using Quantum Espresso

status beta

AiiDA >=1.0.0a0

General information

Install pip install git+https://github.com/DanielMarchand/aiida-alloy

Source code https://github.com/DanielMarchand/aiida-alloy

Documentation No documentation provided by the package author.

Author(s) The AiiDA developers group

Python import import aiida_alloy

Latest version 0.1.0a0

Registry checks

W003: Missing classifier 'Framework :: AiiDA'

W006: 'development_status' key is deprecated. Use PyPI Trove classifiers in the plugin repository instead.

W010: Entry point 'elastic' does not start with prefix 'alloy.'

E001: Failed to install plugin aiida-alloy<pre>Collecting git+https://github.com/DanielMarchand/aiida-alloy Cloning https://github.com/DanielMarchand/aiida-alloy to /tmp/pip-req-build-sjls1pif Running command git clone --filter=blob:none --quiet https://github.com/DanielMarchand/aiida-alloy /tmp/pip-req-build-sjls1pif Resolved https://github.com/DanielMarchand/aiida-alloy to commit dfae54b29291dfe94d4a5ca136738020f447bc1e Preparing metadata (setup.py): started Preparing metadata (setup.py): finished with status 'error' error: subprocess-exited-with-error × python setup.py egg_info did not run successfully. │ exit code: 1 ╰─> [6 lines of output] Traceback (most recent call last): File "<string>", line 2, in <module> File "<pip-setuptools-caller>", line 34, in <module> File "/tmp/pip-req-build-sjls1pif/setup.py", line 20, in <module> long_description=open('README.md').read(), FileNotFoundError: [Errno 2] No such file or directory: 'README.md' [end of output] note: This error originates from a subprocess, and is likely not a problem with pip. error: metadata-generation-failed × Encountered error while generating package metadata. ╰─> See above for output. note: This is an issue with the package mentioned above, not pip. hint: See above for details. </pre>

Click any code (W001, E001…) to jump to troubleshooting instructions .

Plugins provided

Workflows 1

Entry points

WorkChains and work functions aiida.workflows

elastic
aiida_alloy.workflows.ElasticWorkChain:ElasticWorkChain