Publications
] Accurate multi-objective design in a space of millions of transition metal complexes with neural-network-driven efficient global optimization,
, ACS Central Science, Volume 6, p.513-524, (2020)
About Us
The Kulik group focuses on the development and application of new electronic structure methods and atomistic simulations tools in the broad area of catalysis.
Our Interests
We are interested in transition metal chemistry, with applications from biological systems (i.e. enzymes) to nonbiological applications in surface science and molecular catalysis.
Our Focus
A key focus of our group is to understand mechanistic features of complex catalysts and to facilitate and develop tools for computationally driven design.
Contact Us
Questions or comments? Let us know! Contact Dr. Kulik: