Role of steps in N-2 activation on Ru(0001)

Autor: Dahl, Søren, Logadottir, Ashildur, Egeberg, Rasmus, Nielsen, Jane Hvolbæk, Chorkendorff, Ib, Törnqvist, Eric, Nørskov, Jens Kehlet
Jazyk: angličtina
Rok vydání: 1999
Předmět:
Zdroj: Dahl, S, Logadottir, A, Egeberg, R, Nielsen, J H, Chorkendorff, I, Törnqvist, E & Nørskov, J K 1999, ' Role of steps in N-2 activation on Ru(0001) ', Physical Review Letters, vol. 83, no. 9, pp. 1814-1817 . https://doi.org/10.1103/PhysRevLett.83.1814
DOI: 10.1103/PhysRevLett.83.1814
Popis: Using adsorption experiments and density functional calculations we show that N-2 dissociation on the Ru(0001) surface is totally dominated by steps. The measured adsorption rate at the steps is at least 9 orders of magnitude higher than on the terraces at 500 K, and the corresponding calculated difference in activation energy is 1.5 eV. The low barrier at the step is shown to be due to a combination of electronic and geometrical effects. The consequences for Ru as a catalyst for ammonia synthesis are discussed.
Databáze: OpenAIRE