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Page 1
Adsorption-induced step formation.
Thostrup P, Christoffersen E, Lorensen HT, Jacobsen KW, Besenbacher F, Nørskov JK. Thostrup P, et al. Among authors: jacobsen kw. Phys Rev Lett. 2001 Sep 17;87(12):126102. doi: 10.1103/PhysRevLett.87.126102. Epub 2001 Aug 30. Phys Rev Lett. 2001. PMID: 11580529
One-dimensional metallic edge states in MoS2.
Bollinger MV, Lauritsen JV, Jacobsen KW, Nørskov JK, Helveg S, Besenbacher F. Bollinger MV, et al. Among authors: jacobsen kw. Phys Rev Lett. 2001 Nov 5;87(19):196803. doi: 10.1103/PhysRevLett.87.196803. Epub 2001 Oct 18. Phys Rev Lett. 2001. PMID: 11690441
Beta-sheet preferences from first principles.
Rossmeisl J, Kristensen I, Gregersen M, Jacobsen KW, Nørskov JK. Rossmeisl J, et al. Among authors: jacobsen kw. J Am Chem Soc. 2003 Dec 31;125(52):16383-6. doi: 10.1021/ja0359658. J Am Chem Soc. 2003. PMID: 14692780
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: jacobsen kw. 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
Density functional theory based screening of ternary alkali-transition metal borohydrides: a computational material design project.
Hummelshøj JS, Landis DD, Voss J, Jiang T, Tekin A, Bork N, Dułak M, Mortensen JJ, Adamska L, Andersin J, Baran JD, Barmparis GD, Bell F, Bezanilla AL, Bjork J, Björketun ME, Bleken F, Buchter F, Bürkle M, Burton PD, Buus BB, Calborean A, Calle-Vallejo F, Casolo S, Chandler BD, Chi DH, Czekaj I, Datta S, Datye A, DeLaRiva A, Despoja V, Dobrin S, Engelund M, Ferrighi L, Frondelius P, Fu Q, Fuentes A, Fürst J, García-Fuente A, Gavnholt J, Goeke R, Gudmundsdottir S, Hammond KD, Hansen HA, Hibbitts D, Hobi E Jr, Howalt JG, Hruby SL, Huth A, Isaeva L, Jelic J, Jensen IJ, Kacprzak KA, Kelkkanen A, Kelsey D, Kesanakurthi DS, Kleis J, Klüpfel PJ, Konstantinov I, Korytar R, Koskinen P, Krishna C, Kunkes E, Larsen AH, Lastra JM, Lin H, Lopez-Acevedo O, Mantega M, Martínez JI, Mesa IN, Mowbray DJ, Mýrdal JS, Natanzon Y, Nistor A, Olsen T, Park H, Pedroza LS, Petzold V, Plaisance C, Rasmussen JA, Ren H, Rizzi M, Ronco AS, Rostgaard C, Saadi S, Salguero LA, Santos EJ, Schoenhalz AL, Shen J, Smedemand M, Stausholm-Møller OJ, Stibius M, Strange M, Su HB, Temel B, Toftelund A, Tripkovic V, Vanin M, Viswanathan V, Vojvodic A, Wang S, Wellendorff J, Thygesen KS, Rossmeisl J, Bligaard T, Jacobsen… See abstract for full author list ➔ Hummelshøj JS, et al. Among authors: jacobsen kw. J Chem Phys. 2009 Jul 7;131(1):014101. doi: 10.1063/1.3148892. J Chem Phys. 2009. PMID: 19586090 Free article.
Electronic structure calculations with GPAW: a real-space implementation of the projector augmented-wave method.
Enkovaara J, Rostgaard C, Mortensen JJ, Chen J, Dułak M, Ferrighi L, Gavnholt J, Glinsvad C, Haikola V, Hansen HA, Kristoffersen HH, Kuisma M, Larsen AH, Lehtovaara L, Ljungberg M, Lopez-Acevedo O, Moses PG, Ojanen J, Olsen T, Petzold V, Romero NA, Stausholm-Møller J, Strange M, Tritsaris GA, Vanin M, Walter M, Hammer B, Häkkinen H, Madsen GK, Nieminen RM, Nørskov JK, Puska M, Rantala TT, Schiøtz J, Thygesen KS, Jacobsen KW. Enkovaara J, et al. Among authors: jacobsen kw. J Phys Condens Matter. 2010 Jun 30;22(25):253202. doi: 10.1088/0953-8984/22/25/253202. Epub 2010 Jun 10. J Phys Condens Matter. 2010. PMID: 21393795
87 results