LICENSE
README.md
pyproject.toml
agent_materials_science/__init__.py
agent_materials_science/__main__.py
agent_materials_science/agent.py
agent_materials_science/cli.py
agent_materials_science/config.py
agent_materials_science/py.typed
agent_materials_science.egg-info/PKG-INFO
agent_materials_science.egg-info/SOURCES.txt
agent_materials_science.egg-info/dependency_links.txt
agent_materials_science.egg-info/entry_points.txt
agent_materials_science.egg-info/requires.txt
agent_materials_science.egg-info/top_level.txt
agent_materials_science/core/__init__.py
agent_materials_science/core/adsorption.py
agent_materials_science/core/surface.py
agent_materials_science/core/workflow.py
agent_materials_science/tools/__init__.py
agent_materials_science/tools/ase_tools.py
agent_materials_science/tools/converters.py
agent_materials_science/tools/fairchem_calc.py
agent_materials_science/tools/materials_project.py
tests/test_adsorption.py
tests/test_config.py
tests/test_references.py
tests/test_surface.py