Locating the rate-limiting step for the interaction of hydrogen with Mg ( 0001 ) using density-functional theory calculations and rate theory
By Tejs Vegge. 2004
153 citations recorded by the source corpus.
Subfields: Atomic and Molecular Physics, and Optics, Materials Chemistry
View Paper: https://www.semanticscholar.org/paper/abc8baa010673daea5804ede21a5ddc07e467314
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In Atomic and Molecular Physics, and Optics
In Materials Chemistry
Citations in the corpus
- Hydrogen dissociation and diffusion on transition metal (= Ti, Zr, V, Fe, Ru, Co, Rh, Ni, Pd, Cu, Ag)-doped Mg(0001) surfaces (2008, result): “[45] Vegge T. Locating the rate-limiting step for the interaction of hydrogen with Mg(0001) using density-functional theory calculations and rate theory.”
- Materials for hydrogen-based energy storage – past, recent progress and future outlook (2019, unknown): “tion kinetics in bulk coarse-grain Mg are extremely slow. This results from kinetic limitations on both dissociation of hydrogen molecules at the Mg surface and diffusion of hydrogen atoms in bulk Mg [14,16, 45,225]. Surface limitations can be overcome by decoration of the metal surface with catalys”