Publications Details

Predicting the Electronic Structure of Matter on Ultra-Large Scales

Fiedler, Lenz; Modine, Normand A.; Schmerler, Steve; Vogel, Dayton J.; Popoola, Gabriel A.; Thompson, A.P.; Rajamanickam, Sivasankaran; Cangi, Attila

The long-standing problem of predicting the electronic structure of matter on ultra-large scales (beyond 100,000 atoms) is solved with machine learning.