@other{https://resolver.caltech.edu/CaltechTHESIS:12072018-215548214, title = "From Quantum Mechanics to Experimental Observables: Computational Investigations of Energy-Related Heterogeneous Catalysts", url = "https://resolver.caltech.edu/CaltechTHESIS:12072018-215548214", id = "record", doi = "10.7907/SPEJ-5X35" }