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Author:
None
Summary:
A Python agent for automated materials science workflows, focusing on surface adsorption analysis
Latest version:
0.2.2
Required dependencies:
ase
|
mp-api
|
numpy
|
pymatgen
|
python-dotenv
|
scipy
Optional dependencies:
black
|
fairchem-core
|
flake8
|
mypy
|
pytest
|
pytest-cov
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