Guild, C. J., Vovchok, D., Kriz, D. A., Fusté, A. B.
, Hammer, B., Llorca, J., Xu, W., El-Sawy, A., Biswas, S., Rodriguez, J. A., Senanayake, S. D. & Suib, S. L. (2017).
Water-Gas-Shift over Metal-Free Nanocrystalline Ceria: An Experimental and Theoretical Study.
ChemCatChem,
9(8), 1373-1377.
https://doi.org/10.1002/cctc.201700081
Gustafson, J., Westerström, R., Resta, A., Mikkelsen, A., Andersen, J. N., Balmes, O., Torrelles, X., Schmid, M., Varga, P.
, Hammer, B., Kresse, G., Baddeley, C. J. & Lundgren, E. (2009).
Structure and catalytic reactivity of Rh oxides.
Catalysis Today,
145(3-4), 227-235.
https://doi.org/10.1016/j.cattod.2008.11.011
Hamamoto, Y., Pham, T. N., Bisbo, M. K.
, Hammer, B. & Morikawa, Y. (2023).
Machine-learned search for the stable structures of silicene on Ag(111).
Physical Review Materials,
7(12), Artikel 124002.
https://doi.org/10.1103/PhysRevMaterials.7.124002
Hansen, J. Ø., Salazar, E. L., Galliker, P., Wang, J., Sprunger, P. T.
, Li, Z., Lægsgaard, E.
, Wendt, S., Hammer, B. & Besenbacher, F. (2010).
Enhanced Bonding of Silver Nanoparticles on Oxidized TiO2(110).
Journal of Physical Chemistry C,
114(40), 16964-16972.
https://doi.org/10.1021/jp101714r
Hansen, J. Ø., Huo, P., Martinez, U., Salazar, E. L., Wei, Y., Streber, R., Lægsgaard, E.
, Hammer, B., Wendt, S. & Besenbacher, F. (2011).
Direct Evidence for Ethanol Dissociation on Rutile TiO2 (110).
Physical Review Letters,
107, 136102-4.
https://doi.org/10.1103/physrevlett.107.136102
Hansen, J. Ø., Bebensee, R., Martinez, U., Porsgaard, S., Salazar, E. L., Wei, Y.
, Lammich, L., Li, Z., Idriss, H.
, Besenbacher, F., Hammer, B. & Wendt, S. (2016).
Unravelling site-specific photo-reactions of ethanol on rutile TiO2(110).
Scientific Reports,
6, Artikel 21990.
https://doi.org/10.1038/srep21990
Helveg, S., Li, W. X., Bartelt, N. C., Horch, S., Lægsgaard, E.
, Hammer, B. & Besenbacher, F. (2007).
Role of surface elastic relaxations in an O-induced nanopattern on Pt(110)-(1 × 2).
Physical Review Letters,
98, 115501-1.
Hjorth Larsen, A., Mortensen, J. J., Blomqvist, J., Castelli, I. E., Christensen, R., Dulak, M., Friis, J. D., Groves, M. N.
, Hammer, B., Hargus, C., Hermes, E. D., Jennings, P. C., Jensen, P. B., Kermode, J., Kitchin, J. R., Kolsbjerg, E. L., Kubal, J., Kaasbjerg, K., Lysgaard, S. ... Jacobsen, K. W. (2017).
The atomic simulation environment-a Python library for working with atoms.
Journal of Physics: Condensed Matter,
29(27), Artikel 273002.
https://doi.org/10.1088/1361-648X/aa680e
Højrup Hansen, K., Gottschalck, J., Petersen, L.
, Hammer, B., Lægsgaard, E.
, Besenbacher, F. & Stensgaard, I. (2001).
Surface waves on NiAl(110).
Physical Review B,
63, 115421.
Højrup Hansen, K., Sljivancanin, Z.
, Hammer, B., Lægsgaard, E.
, Besenbacher, F. & Stensgaard, I. (2001).
An STM and DFT study of the ordered structures of NO on Pd(111).
Surf. Science,
496.
Holmblad, P. M., Larsen, J. H., Chorkendorff, I., Nielsen, L. P.
, Besenbacher, F., Stensgaard, I., Lægsgaard, E., Kratzer, P.
, Hammer, B. & Nørskov, J. K. (1996).
Designing surface alloys with specific active sites.
Catalysis Letters,
40, 131.
Hornekær, L., Sljivancanin, Z., Xu, W., Otero, R., Rauls, E., Stensgaard, I., Lægsgaard, E.
, Hammer, B. & Besenbacher, F. (2006).
Metastable Structures and Recombination Pathways for Atomic Hydrogen on the Graphite (0001) Surface.
Physical Review Letters,
96, 156104.
Hornekær, L., Rauls, E., Xu, W., Sljivancanin, Z., Otero, R., Stensgaard, I., Lægsgaard, E.
, Hammer, B. & Besenbacher, F. (2006).
Clustering of Chemisorbed H(D) Atoms on the Graphite (0001) Surface due to Preferential Sticking.
Physical Review Letters,
97, 186102.
Huo, P., Hansen, J. Ø., Martinez, U., Salazar, E. L., Streber, R., Wei, Y., Lægsgaard, E.
, Hammer, B., Wendt, S. & Besenbacher, F. (2012).
Ethanol Diffusion on Rutile TiO2(110) Mediated by H Adatoms.
The Journal of Physical Chemistry Letters,
3(3), 283–288.
https://doi.org/10.1021/jz201616z
Jaganathan, R., Tang, Z., Simonsen, F. D. S., Palotás, J., Oomens, J.
, Hammer, B. & Hornekær, L. (2023).
Gas Phase IR Spectra of Hydrogen Functionalised Pentacene. I V. Mennella & C. Joblin (red.),
European Conference on Laboratory Astrophysics ECLA2020: The Interplay of Dust, Ice, and Gas in Space (s. 209-214). Springer.
https://doi.org/10.1007/978-3-031-29003-9_23
Jethwa, S., Kolsbjerg, E. L., Vadapoo, S. R., Lind Cramer , J.
, Lammich, L., Gothelf, K. V., Hammer, B. & Linderoth, T. R. (2017).
Supramolecular Corrals on Surfaces Resulting from Aromatic Interactions of Nonplanar Triazoles.
ACS Nano,
11(8), 8302-8310.
https://doi.org/10.1021/acsnano.7b03484
Jorgensen, A. L., Duncan, D. A.
, Kastorp, C. F. P., Kyhl, L., Tang, Z., Bruix, A.
, Andersen, M., Hammer, B., Lee, T.-L.
, Hornekaer, L. & Balog, R. (2019).
Chemically-resolved determination of hydrogenated graphene-substrate interaction.
Physical Chemistry Chemical Physics,
21(25), 13462-13466.
https://doi.org/10.1039/c9cp02059d
Jorgensen, M. S., Mortensen, H. L., Meldgaard, S. A., Kolsbjerg, E. L., Jacobsen, T. L., Sorensen, K. H.
& Hammer, B. (2019).
Atomistic structure learning.
Journal of Chemical Physics,
151(5), Artikel 054111.
https://doi.org/10.1063/1.5108871
Kløve, M., Sommer, S.
, Iversen, B. B., Hammer, B. & Dononelli, W. (2023).
A Machine-Learning-Based Approach for Solving Atomic Structures of Nanomaterials Combining Pair Distribution Functions with Density Functional Theory.
Advanced Materials,
35(13), Artikel 2208220.
https://doi.org/10.1002/adma.202208220
Kristoffersen, H. H., Hansen, J. Ø., Martinez, U., Wei, Y. Y., Matthiesen, J., Streber, R., Bechstein, R., Lægsgaard, E.
, Besenbacher, F., Hammer, B. & Wendt, S. (2013).
Role of steps in the dissociative adsorption of water on rutile TiO2 (110).
Physical Review Letters,
110(14), Artikel 146101.
https://doi.org/10.1103/PhysRevLett.110.146101
Kruse Vestergaard, E., Thostrup, P., An, T., Lægsgaard, E., Stensgaard, I.
, Hammer, B. & Besenbacher, F. (2002).
Comment on "High pressure adsorbate structures studied by scanning tunneling microscopy: CO on Pt(111) in equilibrium with the gas phase" Physical Review Letters,
88, 259601.
Kühnle, A., Molina, L. M.
, Linderoth, T. R., Hammer, B. & Besenbacher, F. (2004).
Growth of unidirectional molecular rows of cysteine on Au(110)-(1x2) driven by adsorbate-induced surface rearrangements.
Physical Review Letters,
93(8), 86101.
http://www.phys.au.dk/~hammer/74.pdf
Laliberté, M.-A., Lavoie, S.
, Hammer, B., Mahieu, G. & McBreen, P. H. (2008).
Activation in Prochiral Reaction Assemblies on Pt(111).
Journal of the American Chemical Society, (130), 5386-5387.
Lee, S., Molina, L. M., López, M. J., Alonso, J. A.
, Hammer, B., Lee, B., Seifert, S., Winans, R. E., Elam, J. W., Pellin, M. J. & Vajda, S. (2009).
Selective Propene Epoxidation on Immobilized Au6-10 Clusters: The Effect of Hydrogen and Water on Activity and Selectivity.
Angewandte Chemie International Edition,
48(8), 1467 - 1471.
https://doi.org/10.1002/anie.200804154
Lemay, J.-C., Dong, Y., Groves, M. N., Demers-Carpentier, V., Goubert, G., Lafleur-Lambert, R., Boukouvalas, J.
, Hammer, B. & McBreen, P. H. (2016).
A comparative study of diastereomeric complexes formed by a prochiral substrate and three structurally analogous chiral molecules on Pt(111).
Surface Science,
646, 13-18.
https://doi.org/10.1016/j.susc.2015.11.018
Li, W. X., Österlund, L., Vestergaard, E. K., Vang, R. T., Matthiesen, J., Pedersen, T. M., Lægsgaard, E.
, Hammer, B. & Besenbacher, F. (2004).
Oxidation of Pt(110).
Physical Review Letters,
93(14).
http://www.phys.au.dk/~hammer/78.pdf
Lira, E., Hansen, J. Ø., Huo, P., Bechstein, R., Galliker, P., Lægsgaard, E.
, Hammer, B., Wendt, S. & Besenbacher, F. (2010).
Dissociative and molecular oxygen chemisorption channels on reduced rutile TiO2(110): A high-resolution STM study.
Surface Science,
604(21-22), 1945-1960.
https://doi.org/10.1016/j.susc.2010.08.004
Logadottir, A., Rod, T. H., Nørskov, J. K.
, Hammer, B., Dahl, S. & Jacobsen, C. J. H. (2001).
The Bronsted-Evans-Polanyi relation and the volcano plot for ammonia synthesis over transition metal catalysts.
Journal of Catalysis,
197, 229.
Martinez, U., Vilhelmsen, L., Kristoffersen, H. H., Stausholm-Møller, J.
& Hammer, B. (2011).
Steps on rutile TiO2(110): Active sites for water and methanol dissociation.
Physical Review B,
84(20), 205434.
https://doi.org/10.1103/PhysRevB.84.205434
Martinez, U., Hansen, J. Ø., Salazar, E. L., Kristoffersen, H. H., Huo, P., Bechstein, R., Lægsgaard, E.
, Besenbacher, F., Hammer, B. & Wendt, S. (2012).
Reduced step edges on rutile TiO (110) as competing defects to oxygen vacancies on the terraces and reactive sites for ethanol dissociation.
Physical Review Letters,
109(15), 155501.
https://doi.org/10.1103/PhysRevLett.109.155501
Matthey, D., Wang, J.
, Wendt, S., Matthiesen, J., Schaub, R., Lægsgaard, E.
, Hammer, B. & Besenbacher, F. (2007).
Enhanced bonding of gold nanoparticles on oxidized TiO2(110).
Science,
315, 1692-1696.