Karsten Wedel Jacobsen

  1. 2014
  2. Published
  3. 2013
  4. Published

    Bandgap Engineering of Double Perovskites for One- and Two-photon Water Splitting. / Castelli, Ivano Eligio; Thygesen, Kristian Sommer; Jacobsen, Karsten Wedel.

    Materials Research Society Symposium Proceedings. Vol. 1523 2013.

    Publication: Research - peer-reviewArticle in proceedings – Annual report year: 2013

  5. Published

    Computational Screening of Materials for Water Splitting Applications. / Castelli, Ivano Eligio; Jacobsen, Karsten Wedel (Main supervisor); Thygesen, Kristian Sommer (Supervisor).

    Kgs. Lyngby : Technical University of Denmark, 2013. 192 p.

    Publication: ResearchPh.D. thesis – Annual report year: 2013

  6. Published

    Density functional theory studies of transition metal nanoparticles in catalysis. / Greeley, Jeffrey Philip; Rankin, Rees; Zeng, Zhenhua; Chun, Hee-Joon; Clayborne, Andre; Li, Lin; Abild-Pedersen, Frank; Nørskov, Jens Kehlet; Larsen, Ask Hjorth; Kleis, Jesper; Jacobsen, Karsten Wedel; Romero, Nichols.

    In: Abstracts of Papers of the American Chemical Society, Vol. 246, 2013, p. -.

    Publication: Research - peer-reviewConference abstract in journal – Annual report year: 2013

  7. Published

    Direct measurement and modulation of single-molecule coordinative bonding forces in a transition metal complex.. / Hao, Xian; Zhu, Nan; Gschneidtner, Tina; Jonsson, Elvar Ö; Zhang, Jingdong; Moth-Poulsen, Kasper; Wang, Hongda; Thygesen, Kristian S; Jacobsen, Karsten W; Ulstrup, Jens; Chi, Qijin.

    In: Nature Communications, Vol. 4, 2013, p. 2121.

    Publication: Research - peer-reviewJournal article – Annual report year: 2013

  8. Published
  9. Published

    Investigation of Catalytic Finite-Size-Effects of Platinum Metal Clusters. / Li, Lin; Larsen, Ask Hjorth; Romero, Nichols A.; Morozov, Vitali A.; Glinsvad, Christian; Abild-Pedersen, Frank; Greeley, Jeff; Jacobsen, Karsten Wedel; Nørskov, Jens K.

    In: Journal of Physical Chemistry Letters, Vol. 4, No. 1, 2013, p. 222-226.

    Publication: Research - peer-reviewJournal article – Annual report year: 2013

  10. Published

    Performance of genetic algorithms in search for water splitting perovskites. / Jain, A.; Castelli, Ivano Eligio; Hautier, G.; Bailey, D.H. ; Jacobsen, Karsten Wedel.

    In: Journal of Materials Science, Vol. 48, No. 19, 2013, p. 6519-6534.

    Publication: Research - peer-reviewJournal article – Annual report year: 2013

  11. Published
  12. 2012
  13. Published
  14. Published
  15. Published

    Construction of New Electronic Density Functionals with Error Estimation Through Fitting. / Petzold, V.; Bligaard, T.; Jacobsen, K. W.

    In: Topics in Catalysis, Vol. 55, No. 5-6, 2012, p. 402-417.

    Publication: Research - peer-reviewJournal article – Annual report year: 2012

  16. Published
  17. Published
  18. 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: ResearchPh.D. thesis – Annual report year: 2012

  19. Published
  20. Published
  21. Published

    Oxidative trends of TiO2—hole trapping at anatase and rutile surfaces. / Zawadzki, Pawel; Laursen, Anders B.; Jacobsen, Karsten Wedel; Dahl, Søren; Rossmeisl, Jan.

    In: Energy & Environmental Science, Vol. 5, No. 12, 2012, p. 9866-9869.

    Publication: Research - peer-reviewJournal article – Annual report year: 2012

  22. Published
  23. Published
  24. Published
  25. Published

    The Computational Materials Repository. / Landis, David D.; Hummelshøj, Jens S.; Nestorov, Svetlozar; Greeley, Jeff; Dulak, Marcin; Bligaard, Thomas; Nørskov, Jens K.; Jacobsen, Karsten W.

    In: Computing in Science & Engineering, Vol. 14, No. 6, 2012, p. 51-57.

    Publication: Research - peer-reviewJournal article – Annual report year: 2012

  26. Published

    Unraveling the acoustic electron-phonon interaction in graphene. / Kaasbjerg, Kristen; Thygesen, Kristian S.; Jacobsen, Karsten W.

    In: Physical Review B (Condensed Matter and Materials Physics), Vol. 85, No. 16, 2012, p. 165440.

    Publication: Research - peer-reviewJournal article – Annual report year: 2012

  27. Published

    Versatile Density Functionals for Computational Surface Science. / Wellendorff, Jess; Jacobsen, Karsten Wedel (Main supervisor); Bligaard, Thomas (Supervisor).

    Kgs. Lyngby : Technical University of Denmark, 2012. 191 p.

    Publication: ResearchPh.D. thesis – Annual report year: 2012

  28. 2011
  29. 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: ResearchPh.D. thesis – Annual report year: 2011

  30. E-pub ahead of print
  31. Published
  32. Published

    Efficient electronic structure methods applied to metal nanoparticles. / Larsen, Ask Hjorth; Jacobsen, Karsten Wedel (Supervisor); Thygesen, Kristian Sommer (Supervisor).

    Technical University of Denmark, Center for Atomic-Scale Materials Physics, 2011. 172 p.

    Publication: ResearchPh.D. thesis – Annual report year: 2012

  33. Published

    Electronic hole localization in rutile and anatase TiO2 - Self-interaction correction in Delta-SCF DFT. / Zawadzki, Pawel; Jacobsen, Karsten Wedel; Rossmeisl, Jan.

    In: Chemical Physics Letters, Vol. 506, No. 1-3, 2011, p. 42-45.

    Publication: Research - peer-reviewJournal article – Annual report year: 2011

  34. Published
  35. Published

    Electronic shell structure and chemisorption on gold nanoparticles. / Larsen, Ask Hjorth; Kleis, Jesper; Thygesen, Kristian Sommer; Nørskov, J. K.; Jacobsen, Karsten Wedel.

    In: Physical Review B (Condensed Matter and Materials Physics), Vol. 84, No. 24, 2011, p. 245429.

    Publication: Research - peer-reviewJournal article – Annual report year: 2011

  36. Published
  37. Published

    First-principles study of surface plasmons on Ag(111) and H/Ag(111). / Yan, Jun; Jacobsen, Karsten Wedel; Thygesen, Kristian Sommer.

    In: Physical Review B (Condensed Matter and Materials Physics), Vol. 84, No. 23, 2011, p. 235430.

    Publication: Research - peer-reviewJournal article – Annual report year: 2012

  38. Published
  39. Published
  40. Published

    Semiconductor Photocatalysis : Electronic Hole Trapping in TiO2. / Zawadzki, Pawel; Rossmeisl, Jan (Supervisor); Jacobsen, Karsten Wedel (Supervisor).

    Technical University of Denmark, Center for Atomic-Scale Materials Physics, 2011. 138 p.

    Publication: ResearchPh.D. thesis – Annual report year: 2012

  41. Published
  42. 2010
  43. Published

    Electron Interactions & Quantum Transport. / Rostgaard, Carsten; Jacobsen, Karsten Wedel (Supervisor).

    Kgs. Lyngby, Denmark : Technical University of Denmark (DTU), 2010.

    Publication: ResearchPh.D. thesis – Annual report year: 2010

  44. Published
  45. Published
  46. Published
  47. Published

    Electronic structure calculations with GPAW: a real-space implementation of the projector augmented-wave method. / Enkovaara, J.; Rostgaard, Carsten; Mortensen, Jens Jørgen; Chen, Jingzhe; Dulak, M.; Ferrighi, L.; Gavnholt, J.; Glinsvad, Christian; Haikola, V.; Hansen, H.A.; Kristoffersen, H.H.; Kuisma, M.; Larsen, A.H.; Lehtovaara, L.; Ljungberg, M.; Lopez-Acevedo, O.; Moses, Poul Georg; Ojanen, J.; Olsen, T.; Petzold, Vivien Gabriele; Romero, N.A.; Stausholm-Moller, J.; Strange, Mikkel; Tritsaris, Georgios; Vanin, Marco; Walter, M.; Hammer, B.; Hakkinen, H.; Madsen, G.K.H.; Nieminen, R.M.; Nørskov, Jens Kehlet; Puska, M.; Rantala, T.T.; Schiotz, J.; Thygesen, Kristian Sommer; Jacobsen, Karsten Wedel.

    In: Journal of Physics: Condensed Matter, Vol. 22, No. 25, 2010.

    Publication: Research - peer-reviewJournal article – Annual report year: 2010

  48. Published
  49. Published

    First-principles modelling of scanning tunneling microscopy using non-equilibrium Green's functions. / Lin, H.P.; Rauba, J.M.C.; Thygesen, Kristian Sommer; Jacobsen, Karsten Wedel; Simmons, M.Y.; Hofer, W.A.

    In: Frontiers of Physics in China, Vol. 5, No. 4, 2010, p. 369-379.

    Publication: Research - peer-reviewJournal article – Annual report year: 2010

  50. Published

    Fully self-consistent GW calculations for molecules. / Rostgaard, Carsten; Jacobsen, Karsten Wedel; Thygesen, Kristian Sommer.

    In: Physical Review B (Condensed Matter and Materials Physics), Vol. 81, No. 8, 2010, p. 085103.

    Publication: Research - peer-reviewJournal article – Annual report year: 2010

  51. Published
  52. Published
  53. 2009
  54. Published

    Computational Modeling of Molecular Junctions: Transport, Structure and Inelastic effects. / Bækgaard, Iben Sig Buur; Jacobsen, Karsten Wedel (Supervisor); Thygesen, Kristian Sommer (Supervisor).

    Kgs. Lyngby, Denmark : Technical University of Denmark (DTU), 2009.

    Publication: ResearchPh.D. thesis – Annual report year: 2009

  55. Published

    Density functional theory based screening of ternary alkali-transition metal borohydrides: A computational material design project. / Hummelshøj, Jens Strabo; Landis, David; Voss, Johannes; Jiang, Tao; Tekin, Adem; Bork, Nicolai Christian; Dulak, Marcin; Mortensen, Jens Jørgen; Adamska, L.; Andersin, J.; Baran, J.D.; Barmparis, G.D.; Bell, F.; Benzanilla, A.L.; Bjork, J,; Björketun, Mårten; Bleken, F.; Buchter, F.; Bürkle, M.; Burton, P.D.; Buus, Bjarke Brink; Calborean, A.; Casolo, S.; Chandler, B.; Chi, D.H.; Czekaj, I.; Datta, S.; Datye, A.; DeLaRiva, A.; Despoja, V.; Dobrin, Sergey; Engelund, Mads; Ferrighi, L; Frondelius, P.; Fu, Q.; Fuentes, A.; Fürst, Joachim Alexander; Garcia-Fuente, A.; Gavnholt, Jeppe; Goeke, R.; Gudmundsdottir, S.; Hammond, K.D.; Hansen, Heine Anton; Hibbitts, D.; Howalt, Jakob Geelmuyden; Hruby, S. L.; Huth, A.; Isaeva, L.; Jelic, J.; Jensen, I.J.T.; Junior, E.H.; Kacprzak, K.A.; Kelkkanen, Kari André; Kelsey, D.; Kesanakurthi, D.S.; Kleis, Jesper; Klüpfel, P.J.; Konstantinov, I.; Korytar, R.; Koskinen, P.; Ande, C.K.; Kunkes, E.; Larsen, Ask Hjorth; Lastra, J.M.G.; Lin, H.; Lopez-Acevedo, O.; Mantega, M.; Martinez, Jose Ignacio; Mesa, I.N.; Mowbray, Duncan; Mýrdal, J.S.G.; Natanzon, Y.; Nistor, A.; Olsen, Thomas; Park, H.; Pedroza, L.S.; Petzold, Vivien Gabriele; Plaisance, C.; Rasmussen, J.A.; Ren, H.; Rizzi, M.; Ronco, A.S.; Rostgaard, Carsten; Saadi, Souheil; Salguero, L.A.; Santos, E.J.G.; Schoenhalz, A.L.; Shen, Juan; Smedemand, M.; Stausholm-Møller, O.J.; Jensen, Mogens O Stibius; Strange, Mikkel; Su, H.B.; Temel, B.; Toftelund, Anja; Tripkovic, Vladimir; Calle Vallejo, Federico; Vanin, Marco; Viswanathan, V.; Vojvodic, Aleksandra; Wang, Shengguang; Pedersen, Jess Wellendorff; Thygesen, Kristian Sommer; Rossmeisl, Jan; Bligaard, Thomas; Jacobsen, Karsten Wedel; Nørskov, Jens Kehlet; Vegge, Tejs.

    In: Journal of Chemical Physics, Vol. 131, No. 1, 2009, p. 014101.

    Publication: Research - peer-reviewJournal article – Annual report year: 2009

  56. Published

    Inelastic scattering in metal-H-2-metal junctions. / Kristensen, I. S.; Paulsson, Magnus; Thygesen, Kristian Sommer; Jacobsen, Karsten Wedel.

    In: Physical Review B (Condensed Matter and Materials Physics), Vol. 79, No. 23, 2009, p. 235411.

    Publication: Research - peer-reviewJournal article – Annual report year: 2009

  57. Published
  58. Published
  59. 2008
  60. Published
  61. Published
  62. Published

    Anomalous conductance oscillations and half-metallicity in atomic Ag-O chains. / Strange, Mikkel; Thygesen, Kristian Sommer; Sethna, James P; Jacobsen, Karsten Wedel.

    In: Physical Review Letters, Vol. 101, No. 9, 2008, p. 096804.

    Publication: Research - peer-reviewJournal article – Annual report year: 2008

  63. Published
  64. Published
  65. 2007
  66. Published

    Avalanche size scaling in sheared three-dimensional amorphous solid. / Bailey, Nicholas; Schiøtz, Jakob; Lemaître, A.; Jacobsen, Karsten Wedel.

    In: Physical Review Letters, Vol. 98, No. 9, 2007, p. 095501.

    Publication: Research - peer-reviewJournal article – Annual report year: 2007

  67. 2006
  68. Published
  69. Published
  70. Published

    Electronic-Structure-Based Design of Ordered Alloys. / Bligaard, Thomas ; Andersson, M.P.; Jacobsen, Karsten Wedel; Skriver, Hans Lomholt; Christensen, Claus H.; Nørskov, Jens Kehlet.

    In: M R S Bulletin, Vol. 31, No. 12, 2006, p. 986-990.

    Publication: Research - peer-reviewJournal article – Annual report year: 2006

  71. Published
  72. Published

    Fermi level alignment in molecular nanojunctions and its relation to charge transfer. / Stadler, Robert; Jacobsen, Karsten Wedel.

    In: Physical Review B (Condensed Matter and Materials Physics), Vol. 74, No. 16, 2006, p. 164105.

    Publication: Research - peer-reviewJournal article – Annual report year: 2006

  73. 2005
  74. Published

    An ab initio study of electron transport through nitrobenzene: The influence of leads and contacts. / Stadler, Robert; Thygesen, Kristian Sommer; Jacobsen, Karsten Wedel.

    In: Nanotechnology, Vol. 16, 2005, p. S155-S160.

    Publication: Research - peer-reviewJournal article – Annual report year: 2005

  75. Published

    Bayesian error estimation in density-functional theory. / Mortensen, Jens Jørgen; Kaasbjerg, Kristen; Frederiksen, Søren Lund; Nørskov, Jens Kehlet; Sethna, J.P.; Jacobsen, Karsten Wedel.

    In: Physical Review Letters, Vol. 95, No. 21, 2005, p. 216401.

    Publication: Research - peer-reviewJournal article – Annual report year: 2005

  76. Published

    Conduction Mechanism in a Molecular Hydrogen Contact. / Thygesen, Kristian Sommer; Jacobsen, Karsten Wedel.

    In: Physical Review Letters, Vol. 94, No. 3, 2005, p. 036807.

    Publication: Research - peer-reviewJournal article – Annual report year: 2005

  77. Published

    Forces and conductances in a single-molecule bipyridine junction. / Stadler, Robert; Thygesen, Kristian Sommer; Jacobsen, Karsten Wedel.

    In: Physical Review B (Condensed Matter and Materials Physics), Vol. 72, No. 24, 2005, p. 241401.

    Publication: Research - peer-reviewJournal article – Annual report year: 2005

  78. Published
  79. Published

    Molecular transport calculations with Wannier Functions. / Thygesen, Kristian Sommer; Jacobsen, Karsten Wedel.

    In: Chemical Physics, Vol. 319, No. 1-3, 2005, p. 111-125.

    Publication: Research - peer-reviewJournal article – Annual report year: 2005

  80. Published

    Partly occupied Wannier functions. / Thygesen, Kristian Sommer; Hansen, Lars Bruno; Jacobsen, Karsten Wedel.

    In: Physical Review Letters, Vol. 94, No. 2, 2005, p. 026405.

    Publication: Research - peer-reviewJournal article – Annual report year: 2005

  81. Published
  82. Published
  83. Published

    Stretching dependence of the vibration modes of a single-molecule Pt-H-2-Pt bridge. / Djukic, D.; Thygesen, Kristian Sommer; Untiedt, C.; Smit, R.H.M.; Jacobsen, Karsten Wedel; Ruitenbeek, J.M. van.

    In: Physical Review B (Condensed Matter and Materials Physics), Vol. 71, No. 16, 2005, p. 161402.

    Publication: Research - peer-reviewJournal article – Annual report year: 2005

  84. Published

    Structure and transport in nano-scale contacts. / Thygesen, Kristian Sommer; Jacobsen, Karsten Wedel (Supervisor).

    2005.

    Publication: ResearchPh.D. thesis – Annual report year: 2005

  85. 2004
  86. Published
  87. Published

    Atomic-scale insight into structure and morphology changes of MoS2 nanoclusters in hydrotreating catalysts,. / Lauritsen, J.V.; Bollinger, Mikkel; Læsgaard, E.; Jacobsen, Karsten Wedel; Nørskov, Jens Kehlet; Clausen, B.S.; Topsøe, H.; Besenbacher, F.

    In: Journal of Catalysis, Vol. 221, 2004, p. 510-522.

    Publication: Research - peer-reviewJournal article – Annual report year: 2004

  88. Published

    Bayesian ensemble approach to error estimation of interatomic potentials. / Frederiksen, Søren Lund; Jacobsen, Karsten Wedel; Brown, K.S.; Sethna, J.P.

    In: Physical Review Letters, Vol. 93, No. 16, 2004, p. 165501.

    Publication: Research - peer-reviewJournal article – Annual report year: 2004

  89. Published

    Elastic effects behind cooperative bonding inβ-sheets. / Rossmeisl, Jan; Nørskov, Jens Kehlet; Jacobsen, Karsten Wedel.

    In: American Chemical Society. Journal, Vol. 126, 2004, p. 13140-13143.

    Publication: Research - peer-reviewJournal article – Annual report year: 2004

  90. Published
  91. Published

    Simulation of Cu-Mg metallic glass: Thermodynamics and structure. / Bailey, Nicholas; Schiøtz, Jakob; Jacobsen, Karsten Wedel.

    In: Physical Review B (Condensed Matter and Materials Physics), Vol. 69, No. 14, 2004, p. 144205.

    Publication: Research - peer-reviewJournal article – Annual report year: 2004

  92. Published

    Simulations of intergranular fracture in nanocrystalline molybdenum. / Frederiksen, Søren Lund; Jacobsen, Karsten Wedel; Schiøtz, Jakob.

    In: Acta Materialia, Vol. 52, No. 17, 2004, p. 5019-5029.

    Publication: Research - peer-reviewJournal article – Annual report year: 2004

  93. 2003
  94. Published

    A maximum in the strength of nanocrystalline copper. / Schiøtz, Jakob; Jacobsen, Karsten Wedel.

    In: Science, Vol. 301, No. 5638, 2003, p. 1357-1359.

    Publication: Research - peer-reviewJournal article – Annual report year: 2003

  95. Published

    A simple and realistic model system for studying hydrogen bonds in beta-sheets. / Rossmeisl, Jan; Hinnemann, Berit; Jacobsen, Karsten Wedel; Nørskov, Jens Kehlet; Olsen, Ole H.; Pedersen, Jan T.

    In: Journal of Chemical Physics, Vol. 118, No. 21, 2003, p. 9783-9794.

    Publication: Research - peer-reviewJournal article – Annual report year: 2003

  96. Published

    Atomic and electronic structure of MoS2 nanoparticles. / Bollinger, Mikkel; Jacobsen, Karsten Wedel; Nørskov, Jens Kehlet.

    In: Physical Review B (Condensed Matter and Materials Physics), Vol. 67, No. 8, 2003, p. 085410.

    Publication: Research - peer-reviewJournal article – Annual report year: 2003

  97. Published

    beta-sheet preferences from first principles. / Rossmeisl, Jan; Bækgaard, Iben Sig Buur; Gregersen, Misha Marie; Nørskov, Jens Kehlet; Jacobsen, Karsten Wedel.

    In: American Chemical Society. Journal, Vol. 125, No. 52, 2003, p. 16383-16386.

    Publication: Research - peer-reviewJournal article – Annual report year: 2003

  98. Published

    Chemistry of one-dimensional metallic edge states in MoS2 nanoclusters. / Lauritsen, J.V.; Nyberg, M.; Vang, R.T.; Bollinger, Mikkel; Clausen, B.S.; Topsøe, H.; Jacobsen, Karsten Wedel; Nørskov, Jens Kehlet; Besenbacher, Flemming.

    In: Nanotechnology, Vol. 14, 2003, p. 385-389.

    Publication: Research - peer-reviewJournal article – Annual report year: 2003

  99. Published

    Conductance calculations with a wavelet basis set. / Thygesen, Kristian Sommer; Bollinger, Mikkel; Jacobsen, Karsten Wedel.

    In: Physical Review B (Condensed Matter and Materials Physics), Vol. 67, No. 11, 2003, p. 115404.

    Publication: Research - peer-reviewJournal article – Annual report year: 2003

  100. Published

    Density functional theory studies of screw dislocation core structures in bcc metals. / Frederiksen, Søren Lund; Jacobsen, Karsten Wedel.

    In: Philosophical magazine, Vol. 83, No. 3, 2003, p. 365-375.

    Publication: Research - peer-reviewJournal article – Annual report year: 2003

  101. Published

    Four-atom period in the conductance of monatomic al wires. / Thygesen, Kristian Sommer; Jacobsen, Karsten Wedel.

    In: Physical Review Letters, Vol. 91, No. 14, 2003, p. 146801.

    Publication: Research - peer-reviewJournal article – Annual report year: 2003

  102. Published

    Pareto-optimal alloys. / Bligaard, Thomas; Johannesson, Gisli Holmar; Ruban, Andrei; Skriver, Hans Lomholt; Jacobsen, Karsten Wedel; Nørskov, Jens Kehlet.

    In: Applied Physics Letters, Vol. 83, No. 22, 2003, p. 4527-4529.

    Publication: Research - peer-reviewJournal article – Annual report year: 2003

  103. 2002
  104. Published

    Adsorption-induced restructuring of gold nanochains. / Bahn, Sune Rastad; Lopez, Nuria; Nørskov, Jens Kehlet; Jacobsen, Karsten Wedel.

    In: Physical Review B (Condensed Matter and Materials Physics), Vol. 66, No. 8, 2002, p. 081405.

    Publication: Research - peer-reviewJournal article – Annual report year: 2002

  105. Published

    An object-oriented scripting interface to a legacy electronic structure code. / Bahn, Sune Rastad; Jacobsen, Karsten Wedel.

    In: Computing in Science & Engineering, Vol. 4, No. 3, 2002, p. 56-66.

    Publication: Research - peer-reviewJournal article – Annual report year: 2002

  106. Published

    Atomic-scale structure of dislocations revealed by scanning tunneling microscopy and molecular dynamics. / Christiansen, Jesper; Morgenstern, K.; Schiøtz, Jakob; Jacobsen, Karsten Wedel; Braun, K.F.; Rieder, K.H.; Laegsgaard, E.; Besenbacher, Flemming.

    In: Physical Review Letters, Vol. 88, No. 20, 2002, p. 206106.

    Publication: Research - peer-reviewJournal article – Annual report year: 2002

  107. Published
  108. Published

    Computational materials science: Nanoscale plasticity. / Jacobsen, Karsten Wedel; Schiøtz, Jakob.

    In: Nature Materials, Vol. 1, No. 1, 2002, p. 15-16.

    Publication: Research - peer-reviewJournal article – Annual report year: 2002

  109. Published

    Object oriented scripting interface to a legacy electronic structure code. / Bahn, Sune Rastad; Jacobsen, Karsten Wedel.

    In: Computing in Science and Engineering (CiSE), Vol. 4, 2002, p. 56.

    Publication: Research - peer-reviewJournal article – Annual report year: 2002

  110. Published
  111. 2001
  112. Published

    Adsorption-induced step formation. / Thostrup, P.; Christoffersen, Ebbe; Lorensen, Henrik Qvist; Jacobsen, Karsten Wedel; Besenbacher, Flemming; Nørskov, Jens Kehlet.

    In: Physical Review Letters, Vol. 87, No. 12, 2001, p. 126102.

    Publication: Research - peer-reviewJournal article – Annual report year: 2001

  113. Published

    Calculation of quantum tunneling for a spatially extended defect: The dislocation kink in copper has a low effective mass. / Vegge, Tejs; Sethna, J.P.; Cheong, S.-A.; Jacobsen, Karsten Wedel; Myers, C.R.; Ralph, D.C.

    In: Physical Review Letters, Vol. 86, No. 8, 2001, p. 1546-1549.

    Publication: Research - peer-reviewJournal article – Annual report year: 2001

  114. Published

    Chain formation of metal atoms. / Bahn, Sune Rastad; Jacobsen, Karsten Wedel.

    In: Physical Review Letters, Vol. 87, No. 26, 2001, p. 266101.

    Publication: Research - peer-reviewJournal article – Annual report year: 2001

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