| QuantumATK: An integrated platform of electronic and atomic-scale modelling tools S Smidstrup, T Markussen, P Vancraeyveld, J Wellendorff, J Schneider, ... Journal of Physics: Condensed Matter 32 (1), 015901, 2019 | 1609 | 2019 |
| Understanding the electrocatalysis of oxygen reduction on platinum and its alloys IEL Stephens, AS Bondarenko, U Grønbjerg, J Rossmeisl, I Chorkendorff Energy & Environmental Science 5 (5), 6744-6762, 2012 | 1280 | 2012 |
| Tuning the activity of Pt alloy electrocatalysts by means of the lanthanide contraction M Escudero-Escribano, P Malacrida, MH Hansen, UG Vej-Hansen, ... Science 352 (6281), 73-76, 2016 | 986 | 2016 |
| Supplementary Materials for M Escudero-Escribano, P Malacrida, MH Hansen, UG Vej-Hansen, ... | 986* | |
| Pt5Gd as a Highly Active and Stable Catalyst for Oxygen Electroreduction M Escudero-Escribano, A Verdaguer-Casadevall, P Malacrida, ... Journal of the American Chemical Society 134 (40), 16476-16479, 2012 | 301 | 2012 |
| First-principles Green's-function method for surface calculations: A pseudopotential localized basis set approach S Smidstrup, D Stradi, J Wellendorff, PA Khomyakov, UG Vej-Hansen, ... Physical Review B 96 (19), 195309, 2017 | 285 | 2017 |
| Understanding the catalytic activity of gold nanoparticles through multi-scale simulations SH Brodersen, U Grønbjerg, B Hvolbæk, J Schiøtz Journal of Catalysis 284 (1), 34-41, 2011 | 84 | 2011 |
| Correlation between diffusion barriers and alloying energy in binary alloys UG Vej-Hansen, J Rossmeisl, IEL Stephens, J Schiøtz Physical Chemistry Chemical Physics 18 (4), 3302-3307, 2016 | 51 | 2016 |
| New platinum alloy catalysts for oxygen electroreduction based on alkaline earth metals UG Vej-Hansen, M Escudero-Escribano, A Velázquez-Palenzuela, ... Electrocatalysis 8, 594-604, 2017 | 30 | 2017 |
| PtxGd alloy formation on Pt(111): Preparation and structural characterization ET Ulrikkeholm, AF Pedersen, UG Vej-Hansen, M Escudero-Escribano, ... Surface Science 652, 114-122, 2016 | 23 | 2016 |
| Computer simulations of nanoindentation in Mg–Cu and Cu–Zr metallic glasses A Păduraru, UG Andersen, A Thyssen, NP Bailey, KW Jacobsen, ... Modelling and Simulation in Materials Science and Engineering 18 (5), 055006, 2010 | 16 | 2010 |
| H 2/D 2 exchange reaction on mono-disperse Pt clusters: enhanced activity from minute O 2 concentrations JN Riedel, MD Rötzer, M Jørgensen, UG Vej-Hansen, T Pedersen, ... Catalysis Science & Technology 6 (18), 6893-6900, 2016 | 12 | 2016 |
| First Theoretical Modeling of the Bandgap-Engineered Oxynitride Tunneling Dielectric for 3D Flash Memory Devices Starting from the Ab Initio Calculation of the Band Diagram to … WC Chen, HT Lue, ST Fan, TH Hsu, PC Jhang, UG Vej-Hansen, ... 2021 IEEE International Electron Devices Meeting (IEDM), 8.3. 1-8.3. 4, 2021 | 10 | 2021 |
| Correlating structure and oxygen reduction activity on Y/Pt (111) and Gd/Pt (111) Single crystals ET Ulrikkeholm, AF Pedersen, TP Johansson, P Malacrida, ... Electrochemical Society Meeting Abstracts sofc2015, 668-668, 2015 | 3 | 2015 |
| Structure, activity, and stability of platinum alloys as catalysts for the oxygen reduction reaction UG Vej-Hansen Department of Physics, Technical University of Denmark, 2015 | 3 | 2015 |
| Engineering the Activity and Stability of Pt-Alloy Cathode Fuel-Cell Electrocatalysts by Tuning the Pt-Pt Distance M Escudero-Escribano, P Malacrida, UG Vej-Hansen, V Tripkovic, ... Meeting Abstracts, 1038-1038, 2014 | 2 | 2014 |
| First-Principles Study of Charged Point Defects in 4H-SiC: Accurate Formation Energies, Trap Levels, and Beyond H Miyagi, UG Vej-Hansen, BA Wells, JN Luy, C Zechner 2023 International Conference on Simulation of Semiconductor Processes and …, 2023 | 1 | 2023 |
| Atomistic Modeling Of Nanoscale Ferroelectric Capacitors Using a Density Functional Theory And Non-Equilibrium Green’s-Function Method D Stradi, UG Vej-Hansen, PA Khomyakov, ME Lee, G Penazzi, A Blom, ... 2019 International Conference on Simulation of Semiconductor Processes and …, 2019 | 1 | 2019 |
| A Multiscale Simulation Approach for Program Noise and Cross-temperature Effects in 3D NANDs KH Lin, SM Amoroso, PC Chen, YY Tseng, AR Brown, P Asenov, ... 2024 International Conference on Simulation of Semiconductor Processes and …, 2024 | | 2024 |
| First-principles study of electron transport through phase-engineered Au - Mo Te2contacts ME Lee, UG Vej-Hansen, PA Khomyakov, D Stradi, J Wellendorff, ... 2018 48th European Solid-State Device Research Conference (ESSDERC), 38-41, 2018 | | 2018 |
Ifan E. L. StephensImperial College LondonVerified email at imperial.ac.uk