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The Brønsted–Evans–Polanyi Relation and the Volcano Plot for Ammonia Synthesis over Transition Metal Catalysts
Journal of Catalysis · 2001 · Vol. 197(2) · pp. 229–231
Á. Logadóttir(Technical University of Denmark)Thomas H. Rod(Technical University of Denmark)Jens K. Nørskov✉(Technical University of Denmark)Bjørk Hammer(Aarhus University)Søren Dahl(Haldor Topsoe (Denmark))Claus J. H. Jacobsen(Haldor Topsoe (Denmark))
Ammonia Synthesis and Nitrogen ReductionHydrogen Storage and MaterialsCatalytic Processes in Materials ScienceChemistryCatalysisTransition metalDissociation (chemistry)Ammonia productionThermodynamicsAdsorptionActivation energyNitrogenBrønsted–Lowry acid–base theory
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References
Improved adsorption energetics within density-functional theory using revised Perdew-Burke-Ernzerhof functionals
Physical review. B, Condensed matter · 1999 · 8,054 citations
Soft self-consistent pseudopotentials in a generalized eigenvalue formalism
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