A-Lab discovers new inorganic compounds
An autonomous synthesis platform produced novel, ICSD-absent inorganic materials over 17 days of largely unattended operation.
- 1. Plan DFT-screen candidate stoichiometries; rank by predicted stability.
- 2. Synthesize Robot weighs precursors, mixes, and fires them in a tube furnace.
- 3. Measure Run XRD on the quenched powder; cluster phases against the ICSD.
- 4. Analyze Refine cell parameters; flag novel phases.
- 5. Decide Promote the phase to the catalogue; queue follow-up characterisation.
Primary paper Szymanski et al., Nature (2023) doi:10.1038/s41586-023-06734-w