AI accelerators deliver accurate models for challenging quantum chemistry calculations

The most demanding calculations in quantum chemistry can now be solved with graphics processing unit (GPU) supercomputers. A ...
Michigan Technological University

Researchers Apply Machine Learning and AI in Search of Less Costly Electronic Structure Method

Electron density prediction for a four-million-atom aluminum system using machine learning, deemed to be infeasible using traditional DFT method. × Researchers from Michigan Tech and the University of ...