Jens Kehlet Nørskov
- 2012
- Published
A theoretical evaluation of possible transition metal electro-catalysts for N2 reduction. / Skulason, Egill; Bligaard, Thomas; Gudmundsdottir, Sigrıdur; Studt, Felix; Rossmeisl, Jan; Abild-Pedersen, Frank; Vegge, Tejs; Jonsson, Hannes; Nørskov, Jens Kehlet.
In: Physical Chemistry Chemical Physics, Vol. 14, No. 3, 2012, p. 1235-1245.Publication: Research - peer-review › Journal article – Annual report year: 2011
- Published
Inclusion of Dispersion Effects in Density Functional Theory : Development and Application. / Møgelhøj, Andreas; Jacobsen, Karsten Wedel (Main supervisor); Nørskov, Jens Kehlet (Supervisor).
Kgs. Lyngby : Technical University of Denmark, 2012. 207 p.Publication: Research › Ph.d. thesis – Annual report year: 2012
- Published
Ni-Ga intermetallic compounds as novel catalysts for CO2 hydrogenation to methanol. / Sharafutdinov, Irek; Elkjær, Christian Fink; Damsgaard, Christian Danvad; Gardini, Diego; Studt, Felix; Abild-Pedersen, Frank; Nørskov, Jens Kehlet; Dahl, Søren.
2012. Poster session presented at 15th Nordic Symposium on Catalysis, Mariehamn, Åland Islands.Publication: Research - peer-review › Poster – Annual report year: 2012
- Published
Photoelectrocatalysis and electrocatalysis on silicon electrodes decorated with cubane-like clusters. / Hou, Yidong; Abrams, Billie L.; Vesborg, Peter Christian Kjærgaard; Björketun, Mårten; Herbst, Konrad; Bech, Lone; Seger, Brian; Pedersen, Thomas; Hansen, Ole; Rossmeisl, Jan; Dahl, Søren; Nørskov, Jens Kehlet; Chorkendorff, Ib.
In: Journal of Photonics for Energy, Vol. 2, 2012.Publication: Research - peer-review › Journal article – Annual report year: 2012
- Published
Search Directions for Direct H2O2 Synthesis Catalysts Starting from Au-12 Nanoclusters. / Grabow, Lars; Larsen, Britt Hvolbæk; Falsig, Hanne; Nørskov, Jens Kehlet.
In: Topics in Catalysis, Vol. 55, No. 5-6, 2012, p. 336-344.Publication: Research - peer-review › Journal article – Annual report year: 2012
- 2011
- Published
Accurate treatment of nanoelectronics through improved description of van der Waals Interactions. / Kelkkanen, Kari André; Jacobsen, Karsten Wedel (Supervisor); Nørskov, Jens Kehlet (Supervisor).
Kgs. Lyngby, Denmark : Technical University of Denmark (DTU), 2011.Publication: Research › Ph.d. thesis – Annual report year: 2011
- Published
Ab initio van der waals interactions in simulations of water alter structure from mainly tetrahedral to high-density-like.. / Møgelhøj, Andreas; Kelkkanen, Kari André; Wikfeldt, K Thor; Schiøtz, Jakob; Mortensen, Jens Jørgen; Pettersson, Lars G M; Lundqvist, Bengt; Jacobsen, Karsten Wedel; Nilsson, Anders; Nørskov, Jens Kehlet.
In: Journal of Physical Chemistry Part B: Condensed Matter, Materials, Surfaces, Interfaces & Biophysical, Vol. 115, No. 48, 2011, p. 14149-14160.Publication: Research - peer-review › Journal article – Annual report year: 2011
- Published
Atomic-Scale Modeling of Particle Size Effects for the Oxygen Reduction Reaction of Pt. / Tritsaris, Georgios; Greeley, Jeffrey Philip; Rossmeisl, Jan; Nørskov, Jens Kehlet.
In: Catalysis Letters, Vol. 141, No. 7, 2011, p. 909-913.Publication: Research - peer-review › Journal article – Annual report year: 2011
- Published
Bio-inspired co-catalysts bonded to a silicon photocathode for solar hydrogen evolution. / Hou, Yidong (Invited author); Abrams, Billie (Invited author); Vesborg, Peter Christian Kjærgaard (Invited author); Björketun, Mårten (Invited author); Herbst, Korad (Invited author); Bech, Lone (Invited author); Seger, Brian (Invited author); Pedersen, Thomas (Invited author); Hansen, Ole (Invited author); Rossmeisl, Jan (Invited author); Dahl, Søren (Invited author); Nørskov, Jens Kehlet (Invited author); Chorkendorff, Ib (Invited author).
In: Proceedings of SPIE. ed. / Yasuhiro Tachibana. Vol. 8109 SPIE - International Society for Optical Engineering, 2011.Publication: Research - peer-review › Article in proceedings – Annual report year: 2011
- Published
Density functional theory in surface chemistry and catalysis. / Nørskov, Jens Kehlet; Abild-Pedersen, Frank; Studt, Felix; Bligaard, Thomas.
In: National Academy of Sciences. Proceedings, Vol. 108, No. 3, 2011, p. 937-943.Publication: Research - peer-review › Journal article – Annual report year: 2011
- Published
Electrical conductivity in Li2O2 and its role in determining capacity limitations in non-aqueous Li-O2 batteries. / Viswanathan, V.; Thygesen, Kristian Sommer; Hummelshøj, J.S.; Nørskov, Jens Kehlet; Girishkumar, G.; McCloskey, B.D.; Luntz, A.C.; Luntz, A.C.
In: Journal of Chemical Physics, Vol. 135, No. 21, 2011, p. 214704.Publication: Research - peer-review › Journal article – Annual report year: 2011
- Published
Finite Size Effects in Chemical Bonding: From Small Clusters to Solids. / Kleis, Jesper; Greeley, Jeffrey Philip; Romero, N. A.; Morozov, V. A.; Falsig, Hanne; Larsen, Ask Hjorth; Lu, Jianmin; Mortensen, Jens Jørgen; Dułak, M.; Thygesen, Kristian Sommer; Nørskov, Jens Kehlet; Jacobsen, Karsten Wedel.
In: Catalysis Letters, Vol. 141, No. 8, 2011, p. 1067-1071.Publication: Research - peer-review › Journal article – Annual report year: 2011
- Published
First-principles investigations of Ni3Al(111) and NiAl(110) surfaces at metal dusting conditions. / Saadi, Souheil; Hinnemann, Berit; Appel, Charlotte C.; Helveg, Stig; Abild-Pedersen, Frank; Nørskov, Jens Kehlet.
In: Surface Science, Vol. 605, No. 5-6, 2011, p. 582-592.Publication: Research - peer-review › Journal article – Annual report year: 2011
- Published
Platinum and Palladium Alloys Suitable as Fuel Cell Electrodes. / Nørskov, Jens Kehlet (Inventor); Greeley, Jeffrey Philip (Inventor); Stephens, Ifan (Inventor); Bondarenko, Alexander (Inventor); Johansson, Tobias Peter (Inventor); Hansen, Heine Anton (Inventor); Jaramillo, Thomas (Inventor); Rossmeisl, Jan (Inventor); Chorkendorff, Ib (Inventor).
Patent No.: WO 2011006511. Jan 20, 2011.Publication: Research › Patent – Annual report year: 2011
- Published
Scaling relationships for adsorption energies of C2 hydrocarbons on transition metal surfaces. / Jones, Glenn; Studt, Felix; Abild-Pedersen, Frank; Nørskov, Jens Kehlet; Bligaard, Thomas.
In: Chemical Engineering Science, Vol. 66, No. 24, 2011, p. 6318-6323.Publication: Research - peer-review › Conference article – Annual report year: 2011
- Published
Tailoring the Activity for Oxygen Evolution Electrocatalysis on Rutile TiO2(110) by Transition-Metal Substitution. / Garcia-Mota, Monica; Vojvodic, Aleksandra; Metiu, Horia; Man, Isabela Costinela; Su, Hai-Yan; Rossmeisl, Jan; Nørskov, Jens Kehlet.
In: ChemCatChem, Vol. 3, No. 10, 2011, p. 1607-1611.Publication: Research - peer-review › Journal article – Annual report year: 2011
- Published
The Pt(111)/Electrolyte Interface under Oxygen Reduction Reaction Conditions : An elctrochemical Impedance Spectroscopy Study. / Bondarenko, A.S.; Stephens, Ifan; Hansen, Heine Anton; Perez-Alonso, F.J.; Tripkovic, Vladimir; Johansson, Tobias Peter; Rossmeisl, Jan; Nørskov, Jens Kehlet; Chorkendorff, Ib.
In: Langmuir, Vol. 27, No. 5, 2011, p. 2058.Publication: Research - peer-review › Journal article – Annual report year: 2011
- Published
The role of transition metal interfaces on the electronic transport in lithium–air batteries. / Chen, Jingzhe; Hummelshøj, Jens S.; Thygesen, Kristian Sommer; Mýrdal, Jón Steinar Garðarsson; Nørskov, Jens Kehlet; Vegge, Tejs.
In: Catalysis Today, Vol. 165, No. 1, 2011, p. 2-9.Publication: Research - peer-review › Journal article – Annual report year: 2011
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Trends in Metal Oxide Stability for Nanorods, Nanotubes, and Surfaces. / Mowbray, Duncan; Martinez, Jose Ignacio; Vallejo, Federico Calle; Rossmeisl, Jan; Thygesen, Kristian Sommer; Jacobsen, Karsten Wedel; Nørskov, Jens Kehlet.
In: Journal of Physical Chemistry Part C: Nanomaterials and Interfaces, Vol. 115, No. 5, 2011, p. 2244.Publication: Research - peer-review › Journal article – Annual report year: 2011
- Published
Trends in oxygen reduction and methanol activation on transition metal chalcogenides. / Tritsaris, Georgios; Nørskov, Jens Kehlet; Rossmeisl, Jan.
In: Electrochimica Acta, Vol. 56, No. 27, 2011, p. 9783-9788.Publication: Research - peer-review › Journal article – Annual report year: 2011
- Published
Universal Brønsted-Evans-Polanyi Relations for C–C, C–O, C–N, N–O, N–N, and O–O Dissociation Reactions. / Wang, Shengguang; Temel, Burcin; Shen, Juan; Jones, Glenn; Grabow, Lars; Studt, Felix; Bligaard, Thomas; Abild-Pedersen, Frank; Christensen, Claus H.; Nørskov, Jens Kehlet.
In: Catalysis Letters, Vol. 141, No. 3, 2011, p. 370-373.Publication: Research - peer-review › Journal article – Annual report year: 2011
- Published
Universal transition state scaling relations for (de)hydrogenation over transition metals. / Wang, Shengguang; Petzold, Vivien Gabriele; Tripkovic, Vladimir; Kleis, Jesper; Howalt, Jakob Geelmuyden; Skulason, Egill; Fernández, E. M.; Larsen, Britt Hvolbæk; Jones, Glenn; Toftelund, Anja; Falsig, Hanne; Björketun, Mårten; Studt, Felix; Abild-Pedersen, Frank; Rossmeisl, Jan; Nørskov, Jens Kehlet; Bligaard, Thomas.
In: Physical Chemistry Chemical Physics, Vol. 13, No. 46, 2011, p. 20760-20765.Publication: Research - peer-review › Journal article – Annual report year: 2011
- Published
Van der Waals effect in weak adsorption affecting trends in adsorption, reactivity, and the view of substrate nobility. / Kelkkanen, Kari André; Lundqvist, Bengt; Nørskov, Jens Kehlet.
In: Physical Review B (Condensed Matter and Materials Physics), Vol. 83, No. 11, 2011, p. -.Publication: Research - peer-review › Journal article – Annual report year: 2011
- 2010
- Published
Electro-catalytic reactions at charged solid/liquid interface - a DFT study. / Tripkovic, Vladimir; Nørskov, Jens Kehlet (Supervisor); Rossmeisl, Jan (Supervisor).
Kgs. Lyngby, Denmark : Technical University of Denmark (DTU), 2010. 237 p.Publication: Research › Ph.d. thesis – Annual report year: 2011
- Published
Understanding Catalytic Activity Trends for NO Decomposition and CO Oxidation using Density Functional Theory and Microkinetic Modeling. / Falsig, Hanne; Fehrmann, Rasmus (Supervisor); Nørskov, Jens Kehlet (Supervisor).
Kgs. Lyngby, Denmark : Technical University of Denmark (DTU), 2010. 129 p.Publication: Research › Ph.d. thesis – Annual report year: 2010