Nørskov JK - Search Results

1

Estimations of electric field effects on the oxygen reduction reaction based on the density functional theory.

Karlberg GS, Rossmeisl J, Nørskov JK. Karlberg GS, et al. Among authors: norskov jk. Phys Chem Chem Phys. 2007 Oct 7;9(37):5158-61. doi: 10.1039/b705938h. Epub 2007 Jul 31. Phys Chem Chem Phys. 2007. PMID: 17878993 Free article.

2

Beta-sheet preferences from first principles.

Rossmeisl J, Kristensen I, Gregersen M, Jacobsen KW, Nørskov JK. Rossmeisl J, et al. Among authors: norskov jk. J Am Chem Soc. 2003 Dec 31;125(52):16383-6. doi: 10.1021/ja0359658. J Am Chem Soc. 2003. PMID: 14692780

3

Elastic effects behind cooperative bonding in beta-sheets.

Rossmeisl J, Nørskov JK, Jacobsen KW. Rossmeisl J, et al. Among authors: norskov jk. J Am Chem Soc. 2004 Oct 13;126(40):13140-3. doi: 10.1021/ja0490626. J Am Chem Soc. 2004. PMID: 15469313

4

Bayesian error estimation in density-functional theory.

Mortensen JJ, Kaasbjerg K, Frederiksen SL, Nørskov JK, Sethna JP, Jacobsen KW. Mortensen JJ, et al. Among authors: norskov jk. Phys Rev Lett. 2005 Nov 18;95(21):216401. doi: 10.1103/PhysRevLett.95.216401. Epub 2005 Nov 15. Phys Rev Lett. 2005. PMID: 16384163

5

Changing the activity of electrocatalysts for oxygen reduction by tuning the surface electronic structure.

Stamenkovic V, Mun BS, Mayrhofer KJ, Ross PN, Markovic NM, Rossmeisl J, Greeley J, Nørskov JK. Stamenkovic V, et al. Among authors: norskov jk. Angew Chem Int Ed Engl. 2006 Apr 28;45(18):2897-901. doi: 10.1002/anie.200504386. Angew Chem Int Ed Engl. 2006. PMID: 16596688 No abstract available.

6

A density functional study of the chemical differences between Type I and Type II MoS2-based structures in hydrotreating catalysts.

Hinnemann B, Nørskov JK, Topsøe H. Hinnemann B, et al. Among authors: norskov jk. J Phys Chem B. 2005 Feb 17;109(6):2245-53. doi: 10.1021/jp048842y. J Phys Chem B. 2005. PMID: 16851217

7

Predicting catalysis: understanding ammonia synthesis from first-principles calculations.

Hellman A, Baerends EJ, Biczysko M, Bligaard T, Christensen CH, Clary DC, Dahl S, van Harrevelt R, Honkala K, Jonsson H, Kroes GJ, Luppi M, Manthe U, Nørskov JK, Olsen RA, Rossmeisl J, Skúlason E, Tautermann CS, Varandas AJ, Vincent JK. Hellman A, et al. Among authors: norskov jk. J Phys Chem B. 2006 Sep 14;110(36):17719-35. doi: 10.1021/jp056982h. J Phys Chem B. 2006. PMID: 16956255

8

Calculated phase diagrams for the electrochemical oxidation and reduction of water over Pt(111).

Rossmeisl J, Nørskov JK, Taylor CD, Janik MJ, Neurock M. Rossmeisl J, et al. Among authors: norskov jk. J Phys Chem B. 2006 Nov 2;110(43):21833-9. doi: 10.1021/jp0631735. J Phys Chem B. 2006. PMID: 17064147

9

Density functional theory calculations for the hydrogen evolution reaction in an electrochemical double layer on the Pt(111) electrode.

Skúlason E, Karlberg GS, Rossmeisl J, Bligaard T, Greeley J, Jónsson H, Nørskov JK. Skúlason E, et al. Among authors: norskov jk. Phys Chem Chem Phys. 2007 Jul 7;9(25):3241-50. doi: 10.1039/b700099e. Epub 2007 May 30. Phys Chem Chem Phys. 2007. PMID: 17579732 Free article.

10

Scaling properties of adsorption energies for hydrogen-containing molecules on transition-metal surfaces.

Abild-Pedersen F, Greeley J, Studt F, Rossmeisl J, Munter TR, Moses PG, Skúlason E, Bligaard T, Nørskov JK. Abild-Pedersen F, et al. Among authors: norskov jk. Phys Rev Lett. 2007 Jul 6;99(1):016105. doi: 10.1103/PhysRevLett.99.016105. Epub 2007 Jul 6. Phys Rev Lett. 2007. PMID: 17678168

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