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Ammonia synthesis from first-principles calculations.
Honkala K, Hellman A, Remediakis IN, Logadottir A, Carlsson A, Dahl S, Christensen CH, Nørskov JK. Honkala K, et al. Among authors: norskov jk. Science. 2005 Jan 28;307(5709):555-8. doi: 10.1126/science.1106435. Science. 2005. PMID: 15681379
Predicting catalysis: understanding ammonia synthesis from first-principles calculations.
Hellman A, Baerends EJ, Biczysko M, Bligaard T, Christensen CH, Clary DC, Dahl S, van Harrevelt R, Honkala K, Jonsson H, Kroes GJ, Luppi M, Manthe U, Nørskov JK, Olsen RA, Rossmeisl J, Skúlason E, Tautermann CS, Varandas AJ, Vincent JK. Hellman A, et al. Among authors: norskov jk. J Phys Chem B. 2006 Sep 14;110(36):17719-35. doi: 10.1021/jp056982h. J Phys Chem B. 2006. PMID: 16956255
222 results