J
Jens K. Nørskov
Researcher at Technical University of Denmark
Publications - 723
Citations - 181092
Jens K. Nørskov is an academic researcher from Technical University of Denmark. The author has contributed to research in topics: Catalysis & Density functional theory. The author has an hindex of 184, co-authored 706 publications receiving 146151 citations. Previous affiliations of Jens K. Nørskov include Aarhus University & Fritz Haber Institute of the Max Planck Society.
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The effect of strain for N2 dissociation on Fe surfaces
TL;DR: In this article, the effect of strain on N 2 dissociation on Fe surfaces has been investigated by the use of density functional calculations (DFT), and the strain effect on fcc-Fe(1.1) surfaces with different lattice constants was studied.
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Reactive and nonreactive scattering of N2 from Ru(0001): A six-dimensional adiabatic study
Cristina Díaz,Jonathan Vincent,G. P. Krishnamohan,Roar A. Olsen,Geert-Jan Kroes,Karoliina Honkala,Jens K. Nørskov +6 more
TL;DR: The theoretical results show a strong dependence of reaction on the initial vibrational state and computed angular scattering distributions and parallel translation energy distributions are in good agreement with experiments on scattering, but the theory overestimates vibrational and rotational excitations in scattering.
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Application of a new informatics tool in heterogeneous catalysis: Analysis of methanol dehydrogenation on transition metal catalysts for the production of anhydrous formaldehyde
TL;DR: In this article, the authors demonstrate the utility of a new tool for mapping out the activities and selectivities of transition metals for catalytic reactions using a web-based application called CatApp.
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Understanding the Influence of [EMIM]Cl on the Suppression of the Hydrogen Evolution Reaction on Transition Metal Electrodes.
Jeremy T. Feaster,Anna L. Jongerius,Anna L. Jongerius,Xinyan Liu,Xinyan Liu,Makoto Urushihara,Stephanie A. Nitopi,Stephanie A. Nitopi,Christopher Hahn,Christopher Hahn,Karen Chan,Karen Chan,Jens K. Nørskov,Jens K. Nørskov,Thomas F. Jaramillo,Thomas F. Jaramillo +15 more
TL;DR: It was determined that [EMIM]Cl breaks down at both the working and counter electrodes under reaction conditions under both acidic and basic conditions, which underscores the challenges in employing ionic liquids for electrochemical reactions such as CO2 reduction.
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First-principles investigations of the Ni3Sn alloy at steam reforming conditions
Souheil Saadi,Berit Hinnemann,Stig Helveg,Charlotte C. Appel,Frank Abild-Pedersen,Jens K. Nørskov +5 more
TL;DR: In this article, the structure and surface composition of a Ni3Sn alloy at conditions relevant for the steam reforming reaction was investigated using density functional theory calculations, and it was found that adsorbates preferably bind to Ni as nearest neighbor with Sn as second-nearest neighbor.