Assessing the reliability of calculated catalytic ammonia synthesis rates
Medford, Andrew J., Wellendorff, Jess, Vojvodic, Aleksandra, Studt, Felix, Abild-Pedersen, Frank, Jacobsen, Karsten W., Bligaard, Thomas, Nørskov, Jens K.·2014·Science
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- Electrons to Reactors Multiscale Modeling: Catalytic CO Oxidation over RuO2Sutton, Jonathan E., Lorenzi, Juan M., Krogel, Jaron T., Xiong, Qingang, Pannala, Sreekanth, Matera, Sebastian, Savara, Aditya · 2018 · ACS Catalysis