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Author:
None
License:
LicenseRef-Zer0pa-SAL-7.1
Summary:
Zer0pa Materials Workbench — research infrastructure for in silico materials science discovery
Latest version:
0.1.0
Required dependencies:
deepmd-kit
|
fastapi
|
httpx
|
jsonschema
|
networkx
|
numpy
|
orjson
|
pandas
|
pint
|
pydantic
|
pydantic-settings
|
python-multipart
|
rdflib
|
rich
|
scipy
|
structlog
|
typer
|
uvicorn
Optional dependencies:
ase
|
httpx
|
hypothesis
|
mace-torch
|
mypy
|
pennylane
|
pennylane-lightning
|
phonopy
|
psutil
|
pycalphad
|
pymatgen
|
pyscf
|
pytest
|
pytest-asyncio
|
pytest-cov
|
qiskit
|
qiskit-nature
|
ruff
|
spglib
|
tenacity
|
torch
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