| Title | Navigating Transition-Metal Chemical Space: Artificial Intelligence for First-Principles Design |
| Publication Type | Journal Article |
| Year of Publication | 2021 |
| Authors | Janet, Jon Paul, Duan Chenru, Nandy Aditya, Liu Fang, and Kulik Heather J. |
| Journal | Accounts of Chemical Research |
| Volume | 54 |
| Pagination | 532-545 |
| URL | https://pubs.acs.org/doi/pdf/10.1021/acs.accounts.0c00686 |
| DOI | 10.1021/acs.accounts.0c00686 |
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: