Karsten W. Jacobsen
TitelCiteret afÅr
Softening of nanocrystalline metals at very small grain sizes
J Schiøtz, FD Di Tolla, KW Jacobsen
Nature 391 (6667), 561, 1998
16131998
A maximum in the strength of nanocrystalline copper
J Schiøtz, KW Jacobsen
Science 301 (5638), 1357-1359, 2003
12332003
A maximum in the strength of nanocrystalline copper
J Schiøtz, KW Jacobsen
Science 301 (5638), 1357-1359, 2003
12332003
Real-space grid implementation of the projector augmented wave method
JJ Mortensen, LB Hansen, KW Jacobsen
Physical Review B 71 (3), 035109, 2005
11602005
Electronic structure calculations with GPAW: a real-space implementation of the projector augmented-wave method
J Enkovaara, C Rostgaard, JJ Mortensen, J Chen, M Dułak, L Ferrighi, ...
Journal of Physics: Condensed Matter 22 (25), 253202, 2010
11492010
Nudged elastic band method for finding minimum energy paths of transitions
H Jónsson, G Mills, KW Jacobsen
11281998
An object-oriented scripting interface to a legacy electronic structure code
SR Bahn, KW Jacobsen
Computing in Science & Engineering 4 (3), 56-66, 2002
10152002
Classical and quantum dynamics in condensed phase simulations
H Jónsson, G Mills, KW Jacobsen
World Scientific, 1998
10011998
Interatomic interactions in the effective-medium theory
KW Jacobsen, JK Norskov, MJ Puska
Physical Review B 35 (14), 7423, 1987
9121987
Phonon-limited mobility in n-type single-layer MoS 2 from first principles
K Kaasbjerg, KS Thygesen, KW Jacobsen
Physical Review B 85 (11), 115317, 2012
7552012
Atomic-scale simulations of the mechanical deformation of nanocrystalline metals
J Schiøtz, T Vegge, FD Di Tolla, KW Jacobsen
Physical Review B 60 (17), 11971, 1999
6351999
Quantized conductance in an atom-sized point contact
L Olesen, E Lægsgaard, I Stensgaard, F Besenbacher, J Schio, P Stoltze, ...
Physical Review Letters 72 (14), 2251, 1994
5331994
Density functionals for surface science: Exchange-correlation model development with Bayesian error estimation
J Wellendorff, KT Lundgaard, A Møgelhøj, V Petzold, DD Landis, ...
Physical Review B 85 (23), 235149, 2012
5282012
One-dimensional metallic edge states in MoS 2
MV Bollinger, JV Lauritsen, KW Jacobsen, JK Nørskov, S Helveg, ...
Physical review letters 87 (19), 196803, 2001
4922001
Mechanical properties and formation mechanisms of a wire of single gold atoms
G Rubio-Bollinger, SR Bahn, N Agrait, KW Jacobsen, S Vieira
Physical Review Letters 87 (2), 026101, 2001
4812001
Graphene on metals: A van der Waals density functional study
M Vanin, JJ Mortensen, AK Kelkkanen, JM Garcia-Lastra, KS Thygesen, ...
Physical Review B 81 (8), 081408, 2010
4322010
Phase diagrams for surface alloys
A Christensen, AV Ruban, P Stoltze, KW Jacobsen, HL Skriver, ...
Physical Review B 56 (10), 5822, 1997
4201997
Multidimensional potential energy surface for H 2 dissociation over Cu (111)
B Hammer, M Scheffler, KW Jacobsen, JK Nørskov
Physical review letters 73 (10), 1400, 1994
3991994
The atomic simulation environment—a Python library for working with atoms
AH Larsen, JJ Mortensen, J Blomqvist, IE Castelli, R Christensen, ...
Journal of Physics: Condensed Matter 29 (27), 273002, 2017
3972017
Quantized conductance in atom-sized wires between two metals
M Brandbyge, J Schio, MR So, P Stoltze, KW Jacobsen, JK No, L Olesen, ...
Physical Review B 52 (11), 8499, 1995
3751995
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