Egill Sk˙lason
Egill Sk˙lason
Professor, Faculty of Chemical Engineering, University of Iceland
Verified email at - Homepage
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Scaling Properties of Adsorption Energies for Hydrogen-Containing Molecules<? format?> on Transition-Metal Surfaces
F Abild-Pedersen, J Greeley, F Studt, J Rossmeisl, TR Munter, PG Moses, ...
Physical review letters 99 (1), 016105, 2007
A theoretical evaluation of possible transition metal electro-catalysts for N 2 reduction
E Skulason, T Bligaard, S Gudmundsdˇttir, F Studt, J Rossmeisl, ...
Physical Chemistry Chemical Physics 14 (3), 1235-1245, 2012
Modeling the electrochemical hydrogen oxidation and evolution reactions on the basis of density functional theory calculations
E Sk˙lason, V Tripkovic, ME Björketun, S Gudmundsdˇttir, G Karlberg, ...
The Journal of Physical Chemistry C 114 (42), 18182-18197, 2010
Density functional theory calculations for the hydrogen evolution reaction in an electrochemical double layer on the Pt (111) electrode
E Sk˙lason, GS Karlberg, J Rossmeisl, T Bligaard, J Greeley, H Jˇnsson, ...
Physical Chemistry Chemical Physics 9 (25), 3241-3250, 2007
The oxygen reduction reaction mechanism on Pt (1 1 1) from density functional theory calculations
V Tripković, E Sk˙lason, S Siahrostami, JK N°rskov, J Rossmeisl
Electrochimica Acta 55 (27), 7975-7981, 2010
Universal transition state scaling relations for (de) hydrogenation over transition metals
S Wang, V Petzold, V Tripkovic, J Kleis, JG Howalt, E Skulason, ...
Physical Chemistry Chemical Physics 13 (46), 20760-20765, 2011
Modeling the electrified solid–liquid interface
J Rossmeisl, E Sk˙lason, ME Bj÷rketun, V Tripkovic, JK N°rskov
Chemical Physics Letters 466 (1-3), 68-71, 2008
Electroreduction of N2 to Ammonia at Ambient Conditions on Mononitrides of Zr, Nb, Cr, and V: A DFT Guide for Experiments
Y Abghoui, AL Garden, JG Howalt, T Vegge, E Sk˙lason
Acs Catalysis 6 (2), 635-646, 2016
Enabling electrochemical reduction of nitrogen to ammonia at ambient conditions through rational catalyst design
Y Abghoui, AL Garden, VF Hlynsson, S Bj÷rgvinsdˇttir, H Ëlafsdˇttir, ...
Physical Chemistry Chemical Physics 17 (7), 4909-4918, 2015
Calculations of Product Selectivity in Electrochemical CO2 Reduction
J Hussain, H Jónsson, E Skúlason
Acs Catalysis 8 (6), 5240-5249, 2018
Predicting catalysis: understanding ammonia synthesis from first-principles calculations
A Hellman, EJ Baerends, M Biczysko, T Bligaard, CH Christensen, ...
The Journal of Physical Chemistry B 110 (36), 17719-17735, 2006
Cyclic voltammograms for H on Pt (111) and Pt (100) from first principles
GS Karlberg, TF Jaramillo, E Skulason, J Rossmeisl, T Bligaard, ...
Physical review letters 99 (12), 126101, 2007
Hydrogen adsorption on palladium and palladium hydride at 1 bar
M Johansson, E Skulason, G Nielsen, S Murphy, RM Nielsen, ...
Surface science 604 (7-8), 718-729, 2010
Onset potentials for different reaction mechanisms of nitrogen activation to ammonia on transition metal nitride electro-catalysts
Y Abghoui, E Sk˙lason
Catalysis Today 286, 69-77, 2017
Hydrogenation of CO2 to Methanol by Pt Nanoparticles Encapsulated in UiO-67: Deciphering the Role of the Metal–Organic Framework
ES Gutter°d, A Lazzarini, T Fjermestad, G Kaur, M Manzoli, S Bordiga, ...
Journal of the American Chemical Society 142 (2), 999-1009, 2019
Standard hydrogen electrode and potential of zero charge in density functional calculations
V Tripkovic, ME Bj÷rketun, E Sk˙lason, J Rossmeisl
Physical Review B—Condensed Matter and Materials Physics 84 (11), 115452, 2011
Electrochemical synthesis of ammonia via Mars-van Krevelen mechanism on the (111) facets of group III–VII transition metal mononitrides
Y Abghoui, E Sk˙lason
Catalysis Today 286, 78-84, 2017
Hydrogen evolution reaction catalyzed by transition-metal nitrides
Y Abghoui, E Sk˙lason
The Journal of Physical Chemistry C 121 (43), 24036-24045, 2017
A systematic DFT study of hydrogen diffusion on transition metal surfaces
L Kristinsdˇttir, E Sk˙lason
Surface science 606 (17-18), 1400-1404, 2012
Computational Screening of Rutile Oxides for Electrochemical Ammonia Formation
┴B H÷skuldsson, Y Abghoui, AB Gunnarsdˇttir, E Sk˙lason
ACS Sustainable Chemistry & Engineering 5 (11), 10327-10333, 2017
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