ORB v3 Direct Inf OMAT
Fast neural network potential for inorganic materials with direct force prediction. 4x faster inference and lower memory usage compared to conservative mode. Unlimited neighbors for maximum coverage. Ideal for large-scale materials screening and high-throughput applications.
| Version | 3.0.0 |
|---|---|
| Creator | Orbital Materials |
| Delivery | executable |
| Requirements | ram: 3GB; disk: 550MB |
Keywords
materials-scienceinorganic-materialsfast-inferencedirect-predictionneural-network-potentialhigh-throughputlow-memory
Citation
Rhodes, B., Vandenhaute, S., Šimkus, V., Gin, J., Godwin, J., Duignan, T., & Neumann, M. (2025). Orb-v3: atomistic simulation at scale. arXiv:2504.06231