2012

I.E. Castelli, T. Olsen, S. Datta, D.D. Landis, S. Dahl, K.S. Thygesen, and K.W. Jacobsen: Computational screening of perovskite metal oxides for optimal solar light capture, Energy Environ. Sci., 5, 5814 (2012)

E. Skulason, T. Bligaard, S. Gudmundsdottir, F. Studt, J. Rossmeisl, F. Abild-Pedersen, T. Vegge, H. Jonsson, and J.K. Nørskov: A theoretical evaluation of possible transition metal electro-catalysts for N(2) reduction, Phys. Chem. Chem. Phys., 14, 1235 (2012)

K. Kaasbjerg, K.S. Thygesen, and K.W. Jacobsen: Phonon-limited mobility in n-type single-layer MoS2 from first principles, Phys. Rev. B., 85, 115317 (2012)

F. Calle-Vallejo, J.I. Martinez, J.M. Garcia-Lastra, J. Rossmeisl, and M.T.M. Koper: Physical and Chemical Nature of the Scaling Relations between Adsorption Energies of Atoms on Metal Surfaces, Phys. Rev. Lett., 108, 116103 (2012)

V. Viswanathan, H.A. Hansen, J. Rossmeisl, T.F. Jaramillo, H. Pitsch, and J.K. Nørskov: Simulating Linear Sweep Voltammetry from First-Principles: Application to Electrochemical Oxidation of Water on Pt(111) and Pt3Ni(111), J. Phys. Chem. C, 116, 4698 (2012)

V. Tripkovic, F. Abild-Pedersen, F. Studt, I. Cerri, T. Nagami, T. Bligaard, and J. Rossmeisl: Metal Oxide-Supported Platinum Overlayers as Proton-Exchange Membrane Fuel Cell Cathodes, Chem. Cat. Chem., 4, 228 (2012)

A. Valdes, J. Brillet, M. Gratzel, H. Gudmundsdottir, H.A. Hansen, H. Jonsson, P. Klupfel, G.J. Kroes, F. Le Formal, I.C. Man, R.S. Martins, J.K. Nørskov, J. Rossmeisl, K. Sivula, A. Vojvodic, and M. Zach: Solar hydrogen production with semiconductor metal oxides: new directions in experiment and theory, Phys. Chem. Chem. Phys., 14, 49 (2012)

I.E.L. Stephens, A.S. Bondarenko, U. Grønbjerg, J. Rossmeisl, and I. Chorkendorff: Understanding the electrocatalysis of oxygen reduction on platinum and its alloys, Energy & Environmental Science, 5, 6744 (2012)