Latest News

Dr. Xin receives ACS PRF Doctoral New Investigator award studying Metal-Organic Frameworks catalysis. Read full story.

Dr. Xin presents at NACS meeting Pittsburgh, on CO2 electrocatalyst design using a hybrid machine learning and DFT approach.

Welcome Natalie Chen to our group for summer research on mechanistic understanding of carbon-based catalysis.

Dr. Xin presents at 2015 AIChE PDS at Houston, discussing integration of descriptors and neural networks in catalyst design.

Dr. Xin received a 2014-2015 Assistant Professor Mentoring grant from the Office of the Senior Vice President and Provost.

Dr. Xin's work with ultrafast experiments and ab initio simulations on surface dynamics is online Today in Phys. Rev. Lett.

Prof. Xin speaks at HPC day @VT, titled "Catalyzing Energy Transformation with High Performance Computing".

The group enjoyed 2015 NYCS Annual Symposium. Prof. Xin gave a talk, Xianfeng and Zheng presented posters.