Case Study: Intermolecular Inc. Accelerates High-Throughput Alloy Discovery with Mat3ra

A Mat3ra Case Study

Preview of the Intermolecular Inc Case Study

Intermolecular Inc - Customer Case Study

Intermolecular Inc. needed a faster way to study promising advanced metallic alloys and support its high-throughput experimental analysis. To do this, the team used Mat3ra’s exabyte.io discovery platform to run quantum mechanical materials simulations based on density functional theory.

Mat3ra provisioned cloud-scale HPC resources on demand, scaling to 10,656 CPUs within 7 minutes and running 296 materials tasks. The calculations finished in 38 hours, generating formation energies for 296 compounds and delivering results that helped Intermolecular Inc. calibrate its thermodynamic models and guide alloy discovery.


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