metatensor / metatomicLinks
Atomistic machine learning models you can use everywhere for everything
☆15Updated this week
Alternatives and similar repositories for metatomic
Users that are interested in metatomic are comparing it to the libraries listed below
Sorting:
- ☆16Updated last week
- Benchmarking foundation Machine Learning Potentials with Lattice Thermal Conductivity from Anharmonic Phonons☆16Updated 7 months ago
- A fully featured ASE calculator for xTB☆18Updated 7 months ago
- ☆25Updated 6 months ago
- A collection of simulation recipes for the atomic-scale modeling of materials and molecules☆23Updated this week
- Fair and transparent benchmark of machine learning interatomic potentials (MLIPs), beyond basic error metrics☆56Updated this week
- Tools for machine learnt interatomic potentials☆29Updated this week
- ☆21Updated this week
- Compute neighbor lists for atomistic systems