The research activity is centered on first-principles simulations of surfaces (in the form of model planar systems or of the surface of nanomaterial), of the interaction and organization of molecules at these surfaces and of their chemistry and catalytic reactivity. Applications are focused on the sustainable transformation of energy and resources. A large part of the activity aims at understanding molecular reactivity on the surface of heterogeneous catalysts from a computational chemistry approach.


Tieqiang Zeng joins the group

31 March 2019

Tieqiang Zeng from Sinopec is joining our group as a visiting scholar.

Wei Chen joins the group

31 March 2019

Wei Chen from Harvard is joining our group.

Nicole and Huy at SCCUR

April 7

Nicole Chiang and Huy Nguyen present their results at the 2019 Southern California Undergraduate Research Conference in Chemistry and Biochemistry.