Downloads in the 30 and 7 days to October 10, 2026. Refreshed weekly.
Package Information
No reported malware or high/critical advisories · Details
The current version has no OSV.dev malware reports and no critical or high-severity vulnerabilities.
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Dependencies
- ase <4.0,>=3.28
- codecarbon <4.0.0,>=3.0.7
-
numpy
<3,>=1.26.4
python_full_version < "3.13"
- phonopy <5,>=4.5.0
- pymatgen >=2025.1.24
- pyyaml <7.0.0,>=6.0.1
- rich <14.0.0,>=13.9.1
- seekpath <3.0.0,>=1.9.7
- spglib <3.0.0,>=2.3.0
- typer <0.28,>=0.27.2
- typer-config <2.0.0,>=1.4.2
15 optional dependencies
-
chgnet==0.4.2[chgnet]extra == "chgnet"
-
deepmd-kit==3.2.0[deepmd]extra == "deepmd"
-
fairchem-core==2.22.0[fairchem]python_full_version >= "3.12" and extra == "fairchem"
-
graph-longrange==0.4.0[mace]extra == "mace"
-
janus-core[mace]extra == "mace"
-
mace-torch==0.3.16[mace]extra == "mace"
-
mattersim==1.2.5[mattersim]python_full_version >= "3.12" and sys_platform != "win32" and extra == "mattersim"
-
nequip==0.19.1[nequip]extra == "nequip"
-
orb-models==0.7.0[orb]python_full_version == "3.12.*" and sys_platform != "win32" and extra == "orb"
-
plumed<3.0.0,>=2.10.0[plumed]sys_platform != "win32" and extra == "plumed"
-
sevenn==0.13.0[sevennet]extra == "sevennet"
-
tensorpotential==0.6.1[grace]extra == "grace"
-
torch-dftd==0.5.3[d3]extra == "d3"
-
upet==0.3.0[upet]python_full_version >= "3.12" and extra == "upet"
-
weas-widget<0.3,>=0.2.6[visualise]extra == "visualise"
Used By
- aiida-mlip 1.2K/mo
- pack-mm 857/mo
- janus-core-ux 810/mo
- ml-peg 731/mo
- lavello-mlips 175/mo
- soft-learn-project 78/mo