Ab initio molecular simulations with numeric atom-centered orbitals V Blum, R Gehrke, F Hanke, P Havu, V Havu, X Ren, K Reuter, ...
Computer Physics Communications 180 (11), 2175-2196, 2009
3049 2009 Adsorption of aromatic and anti-aromatic systems on graphene through π− π stacking J Björk, F Hanke, CA Palma, P Samori, M Cecchini, M Persson
The Journal of Physical Chemistry Letters 1 (23), 3407-3412, 2010
445 2010 High-Resolution Molecular Orbital Imaging Using a L Gross, N Moll, F Mohn, A Curioni, G Meyer, F Hanke, M Persson
Physical Review Letters 107 (8), 086101, 2011
380 2011 Mechanisms of halogen-based covalent self-assembly on metal surfaces J Bjork, F Hanke, S Stafstrom
Journal of the American Chemical Society 135 (15), 5768-5775, 2013
287 2013 Controlling intramolecular hydrogen transfer in a porphycene molecule with single atoms or molecules located nearby T Kumagai, F Hanke, S Gawinkowski, J Sharp, K Kotsis, J Waluk, ...
Nature chemistry 6 (1), 41-46, 2014
234 2014 Structure and local reactivity of the Au (111) surface reconstruction F Hanke, J Björk
Physical Review B—Condensed Matter and Materials Physics 87 (23), 235422, 2013
201 2013 Clean coupling of unfunctionalized porphyrins at surfaces to give highly oriented organometallic oligomers S Haq, F Hanke, MS Dyer, M Persson, P Iavicoli, DB Amabilino, R Raval
Journal of the American Chemical Society 133 (31), 12031-12039, 2011
158 2011 Two-step mechanism for low-temperature oxidation of vacancies in graphene JM Carlsson, F Hanke, S Linic, M Scheffler
Physical review letters 102 (16), 166104, 2009
156 2009 Zipping up: cooperativity drives the synthesis of graphene nanoribbons J Bjork, S Stafstrom, F Hanke
Journal of the American Chemical Society 133 (38), 14884-14887, 2011
135 2011 Thermally and Vibrationally Induced Tautomerization of Single Porphycene Molecules<? format?> on a Cu (110) Surface T Kumagai, F Hanke, S Gawinkowski, J Sharp, K Kotsis, J Waluk, ...
Physical Review Letters 111 (24), 246101, 2013
128 2013 When can muscovite 40Ar/39Ar dating constrain the timing of metamorphic exhumation? CJ Warren, F Hanke, SP Kelley
Chemical Geology 291, 79-86, 2012
128 2012 Towards design rules for covalent nanostructures on metal surfaces J Björk, F Hanke
Chemistry–A European Journal 20 (4), 928-934, 2014
86 2014 Versatile bottom-up construction of diverse macromolecules on a surface observed by scanning tunneling microscopy S Haq, F Hanke, J Sharp, M Persson, DB Amabilino, R Raval
ACS nano 8 (9), 8856-8870, 2014
80 2014 Solvent effects on electronic excitations of an organic chromophore TJ Zuehlsdorff, PD Haynes, F Hanke, MC Payne, NDM Hine
Journal of Chemical Theory and Computation 12 (4), 1853-1861, 2016
75 2016 Heat-to-connect: Surface commensurability directs organometallic one-dimensional self-assembly F Hanke, S Haq, R Raval, M Persson
ACS nano 5 (11), 9093-9103, 2011
73 2011 Adatoms underneath single porphyrin molecules on Au (111) J Mielke, F Hanke, MV Peters, S Hecht, M Persson, L Grill
Journal of the American chemical society 137 (5), 1844-1849, 2015
66 2015 The Solid‐State Structures of Dimethylzinc and Diethylzinc J Bacsa, F Hanke, S Hindley, R Odedra, GR Darling, AC Jones, A Steiner
Angewandte Chemie International Edition, 2011
63 2011 Sensitivity analysis and uncertainty calculation for dispersion corrected density functional theory F Hanke
Journal of computational chemistry 32 (7), 1424-1430, 2011
61 2011 Breaking bonds in the atomic force microscope: theory and analysis F Hanke, HJ Kreuzer
Physical Review E—Statistical, Nonlinear, and Soft Matter Physics 74 (3 …, 2006
60 2006 Workflow Engineering in Materials Design within the BATTERY 2030+ Project J Schaarschmidt, J Yuan, T Strunk, I Kondov, SP Huber, G Pizzi, L Kahle, ...
Advanced Energy Materials 12 (17), 2102638, 2022
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