CederGroupHub / s4Links
Solid-state synthesis science analyzer. Thermo, features, ML, and more.
☆26Updated 3 years ago
Alternatives and similar repositories for s4
Users that are interested in s4 are comparing it to the libraries listed below
Sorting:
- A python library for accessing the ICSD API Client. Under no affiliation with Fitz-Karlsruhe, please see https://icsd.fiz-karlsruhe.de/in…☆20Updated last year
- Software for evaluating pareto-optimal synthesis pathways☆25Updated last year
- ☆18Updated 2 years ago
- MatTen: Equivariant Graph Neural Nets for Tensorial Properties of Materials☆43Updated last week
- ☆26Updated 2 years ago
- ☆71Updated 2 years ago
- An algorithm to match crystal structures atom-to-atom☆53Updated 2 years ago
- Python package to interact with high-dimensional representations of the chemical elements☆46Updated last week
- Defect analysis modules for pymatgen☆59Updated last week
- The Element Movers Distance for chemical composition similarity☆36Updated 7 months ago
- PhaseForge is a framework for high-throughput alloy phase diagram prediction using machine learning interatomic potentials (MLIPs) integr…☆51Updated last week
- The RASPA plugin for the AiiDA workflow and provenance engine. http://www.aiida.net☆12Updated 2 years ago
- Python package to analyse the structural dynamics of perovskites☆46Updated 3 months ago
- GRACE models and gracemaker (as implemented in TensorPotential package)☆75Updated 3 weeks ago
- Python interface for the zeo++ package☆15Updated 3 months ago
- Clean, Uniform and Refined with Automatic Tracking from Experimental Database (CURATED) COFs☆44Updated 2 years ago
- DistMLIP: A Distributed Inference Library for Fast, Large Scale Atomistic Simulation☆86Updated 2 months ago
- scripts to load all data from ICSD, Materials Project, and OQMD☆67Updated 3 years ago
- ☆21Updated 5 years ago
- PACMOF is a small and easy to use python library that uses machine Learning to quickly estimate partial atomic charges in metal-organic …☆17Updated last year
- Online resource for a practical course in machine learning for materials research at Imperial College London (MATE70026)☆97Updated last month
- OVITO Python modifier to generate bulk crystal structures with target Warren-Cowley parameters.☆27Updated 9 months ago
- Statistical Mechanics on Lattices☆90Updated last week
- Compiled binaries and sources of LAMMPS, redistributed by AdvanceSoft Corp.☆60Updated 4 months ago
- Encode/decode a crystal structure to/from a grayscale PNG image for direct use with image-based machine learning models such as Palette.☆37Updated 2 years ago
- Grand canonical optimization of grain boundary phases.☆29Updated 6 months ago
- Active Learning for Machine Learning Potentials☆61Updated 3 months ago
- Tutorials for using the pymatgen library☆62Updated 5 months ago
- OVITO Python modifier to compute the Warren-Cowley parameters.☆36Updated 7 months ago
- ☆31Updated 2 years ago