Throughout SCHEMA, the Digital & Information Technologies work package will deliver efficient manufacturing through an open-access digital production and product property data platforms, integrating sustainability life-cycle data with structure-property insight to underpin theoretical and predicative models.
The Hub aims to develop:
- Automated chemical syntheses
- Operando process monitoring
- Computational modelling (e.g. QM/MM techniques)
- Machine learning and networked product thermomechanical characterization
Modular automation platforms will digitalise reagent delivery, manufacturing, reactor selection, data monitoring, product isolation, and characterization.