GNoME
Graph networks predicted 2.2 million new crystals, 380,000 of them stable; 736 later independently synthesized.
Active-learning loop between a graph neural network and DFT calculations lifted stability-prediction precision from about 50% to 80%. Released 380,000 stable structures to the Materials Project. Berkeley Lab's A-Lab reported autonomous synthesis in a companion paper.
- Date
- Wednesday, 29 November 2023
- Lab
- Google DeepMind
- Kind
- model
- Access
- research preview
Figures
| Measure | Value | Measured by |
|---|---|---|
| New crystals predicted | 2.2M 380,000 stable; prior computational total 28,000 | company |
Published in Nature 2023-11-29. Counts are model predictions; DeepMind reports 736 independently synthesized by outside groups.
Sources
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