The Computational and Theoretical Chemistry Institute (CTCI) aspires to establish a premier international center for chemistry and materials science software at extreme scales.

The Data-Model Convergence (DMC) Initiative is a multidisciplinary effort to create the next generation of scientific computing capability through a software and hardware co-design methodology.

National laboratories, industry and academia are collaborating to provide electric vehicle manufacturers with batteries that are more reliable, high-performing, safe, and less expensive.