Wednesday, June 5, 2013
Ballroom C (Galt House Hotel)
We use Density Functional Theory to calculate activation energy barriers for various steps in the electrochemical reduction of CO2 on Pt(111). We find that in general, barriers are surmountable (<0.7 eV) at room temperature once the thermodynamics dictate that the step should be thermal neutral.
Extended Abstracts:
- Extended Abstract - Chuan Shi.pdf (243.2KB) - Extended Abstract