| Projektbereich A: Einzelsysteme | 
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L. Lafferentz, V. Eberhardt, C. Dri, C. Africh, G. Comelli, F. Esch, S. Hecht, and L. Grill:Controlling on-surface polymerization by hierarchical and substrate-directed growth,
 Nature Chemistry 4, 215 (2012) (DOI:10.1038/nchem.1242)
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M. Koch, F. Ample, C. Joachim, and L. Grill:Voltage-dependent conductance of a single graphene nanoribbon,
 Nature Nanotechnology 7, 713 (2012) (DOI:10.1038/nnano.2012.169)
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A. Setaro, P. Bluemmel, C. Maity, S. Hecht, S. Reich:Noncovalent Functionalization of Individual Nanotubes with Spiropyran-Based Molecular Switches,
 Adv. Funct. Mater. 22, 2425 (2012) (DOI: 10.1002/adfm.201102451)
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E. Orgiu, N. Crivillers, M. Herder, L. Grubert, M, Pätzel, J. Frisch, E. Pavlica, D. T. Duong, G. Bratina, A. Salleo, N. Koch, S. Hecht, P. Samorì:Optically switchable transistor via energy-level phototuning in a bicomponent organic semiconductor,
 Nature Chemistry 4, 675 (2012) (DOI:10.1038/nchem.1384)
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S. Selvanathan, M. V. Peters, S. Hecht, L. Grill:Island formation and manipulation of prochiral azobenzene derivatives on Au(111),
 J. Phys.: Condens. Matter 24, 354013 (2012) (DOI:10.1088/0953-8984/24/35/354013)
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J. Mielke, S. Selvanathan, M. V. Peters, J. Schwarz, S. Hecht, L. Grill:Molecules with multiple switching units on a Au(111) surface: Self-organization and single-molecule manipulation,
 J. Phys.: Condens. Matter 24, 394013 (2012) (DOI:10.1088/0953-8984/24/39/394013)
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R. Göstl, B. Kobin, L. Grubert, M. Pätzel, S. Hecht:Sterically Crowding the Bridge of Dithienylcyclopentenes for Enhanced Photoswitching Performance,
 Chem. Eur. J. 18, 14282 (2012) (DOI:10.1002/chem.201203111)
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P. Bluemmel, A. Setaro, C. Maity, S. Hecht, S. Reich:Designing a Spiropyran Based Molecular Switch for Carbon Nanotube Functionalization: Influence of Anchor Groups and Tube-Switch Separation,
 Phys. Status Solidi B 249, 2479 (2012) (DOI:10.1002/pssb.201200387)
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D. Bléger, J. Schwarz, A. M. Brouwer, S. Hecht:o-Fluoroazobenzenes as Readily Synthesized Photoswitches Offering Nearly Quantitative Two-Way Isomerization with Visible Light,
 J. Am. Chem. Soc 134, 20597 (2012) (DOI:10.1021/ja310323y)
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G. Schulze, K. J. Franke, J.I. Pascual:Induction of a photostationary ring-opening--ring-closing state of spiropyran monolayers on the semimetallic Bi(110) surface,
 Physical Review Letters 109, 026102 (2012) (DOI:10.1103/PhysRevLett.109.026102)
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T. R. Umbach, I. Fernandez-Torrente, J. N. Ladenthin, J.I. Pascual, K. J. Franke:Enhanced charge transfer in a monolayer of the organic charge transfer complex TTF-TNAP on Au(111),
 J. Phys. Condensed Matter 24, 354003 (2012) (DOI:10.1088/0953-8984/24/35/354003)
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C. Lotze, M. Corso, K. J. Franke, F. von Oppen, J.I. Pascual:Driving a macroscopic oscillator with the stochastic motion of a hydrogen molecule,
 Science 338, 779 (2012) (DOI:10.1126/science.1227621 )
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J. Mielke, S. Selvanathan, M. V. Peters, J. Schwarz, S. Hecht, and L. Grill:Molecules with multiple switching units on a Au(111) surface: self-organization and single-molecule manipulation,
 J. Phys. Condensed Matter 24, 394013 (2012) (DOI:10.1088/0953-8984/24/39/394013)
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S. Selvanathan, M. V. Peters, S. Hecht, and L. Grill:Island formation and manipulation of prochiral azobenzene derivatives on Au(111),
 J. Phys. Condensed Matter 24, 354013 (2012) (DOI:10.1088/0953-8984/24/35/354013)
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J. Yang, C. Nacci, J. Martínez-Blanco, K. Kanisawa, S. Fölsch:Vertical manipulation of native adatoms on the InAs(111)A surface,
 J. Phys. Condensed Matter 24, 354008 (2012) (DOI:10.1088/0953-8984/24/35/354008)
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G. Münnich, F. Albrecht, C. Nacci, M. Utz, K. Kanisawa, S. Fölsch, and J. Repp:Probing individual weakly-coupled π-conjugated molecules on semiconductor surfaces,
 J. Appl. Phys. 112, 034312 (2012) (DOI:10.1063/1.4742977)
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I. F. Torrente, D. Kreikemeyer, A. Strózecka, K. J. Franke, J. I. Pascual:Gating the charge state of single molecules by local electric fields,
 Physical Review Letters 108, 036801 (2012) (DOI:10.1103/PhysRevLett.108.036801)
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K. J. Franke, J. I. Pascual:Effects of electron-vibration coupling in transport through single molecules
 Journal of Physics: Condensed Matter, Topical Review 24, 394002 (2012) (DOI:10.1088/0953-8984/24/39/394002)
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Ch. Lotze, Y. Luo, M. Corso, K.J. Franke, R. Haag, J.I. Pascual:Reversible electron-induced cis-trans isomerization mediated by intermolecular interactions
 Journal of Physics: Condensed Matter 24, 394016 (2012) (DOI:10.1088/0953-8984/24/39/394016)
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L. Lafferentz, V. Eberhardt, C. Dri, C. Africh, G. Comelli, F. Esch, S. Hecht, and L. Gril:Controlling on-surface polymerization by hierarchical and substrate-directed growth,
 Nature Chemistry 4, 215 (2012) ( DOI:10.1038/nchem.1242)
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P.-T. Chiang, J. Mielke, J. Godoy, J. M. Guerrero, L. B. Alemany, C. J. Villagómez, A. Saywell, L. Grill and J. M. Tour:Toward a light-driven motorized nanocar: Synthesis and initial imaging of single molecules,
 ACS Nano 6, 592 (2012) ( DOI:10.1021/nn203969b)
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C. Nacci, S. C. Erwin, K. Kanisawa, S. Fölsch:Controlled Switching within an Organic Molecule Deliberately Pinned to a Semiconductor Surface,
 ACS Nano 6, 4190 (2012) ( DOI:10.1021/nn300690n ) (- abstract -)
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N. Severin, P. Lange, I.M. Sokolov, and J.P. Rabe:Reversible dewetting of a molecularly thin water film in a soft graphene-mica slit pore,
 Nano Lett. (2012) Article ASAP ( DOI:10.1039/nl2037358 )(- abstract -)
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| Projektbereich B: Molekulare Ensembles | 
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P. Bluemmel, A. Setaro, C. Maity, S. Hecht, S. Reich:Tuning the interaction between carbon nanotubes and dipole switches: Influence of the change of the nanotube-spiropyran distance,
 J. Phys.: Condens. Matter 24, 394005 (2012) (DOI:10.1088/0953-8984/24/39/394005)
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R. Tanaka, P. Viehmann, S. Hecht:"Bis(phenoxy-azo)titanium(IV) complexes: Synthesis, Structure, and Catalytic Activity in Styrene Polymerization,
 Organometallics 31, 4216 (2012) (DOI:10.1021/om3001636)
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M. Bernien, D. Wiedemann, C. F. Hermanns, A. Krüger, D. Rolf, W. Kroener, P. Müller, A. Grohmann, and W. Kuch:Spin Crossover in a Vacuum-Deposited Submonolayer of a Molecular Iron(II) Complex ,
 J. Phys. Chem. Lett. 3, 3431 (2012) ( DOI:10.1021/jz3011805 )
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E. Varene, L. Bogner, C. Bronner, and P. Tegeder:Ultrafast exciton population, relaxation and decay dynamics in thin oligothiophene films,
 Phys. Rev. Lett., 109 (2012) 207601 ( DOI:10.1103/PhysRevLett.109.207601 )
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C. S. Guo, L. Sun, K. Hermann, C. F. Hermanns, M. Bernien, and W. Kuch:X-ray Absorption from Large Molecules at Metal Surfaces: Theoretical and Experimental Results for Co-OEP on Ni(100),
 J. Chem. Phys. 137 (2012) 194703 ( DOI:10.1063/1.4765373 )
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T. R. Umbach, M. Bernien, C. F. Hermanns, A. Krüger, I. Fernández-Torrente, P. Stoll, J. I. Pascual, K. J. Franke, and W. Kuch:Ferromagnetic coupling of mononuclear Fe centers in a self-assembled metal organic network on Au(111),
 Phys. Rev. Lett. 109, 267207 (2012) (DOI:10.1103/PhysRevLett.109.267207)
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D. Brete, D. Przyrembel, C. Eickhoff, R. Carley, W. Freyer, K. Reuter, C. Gahl, and M. Weinelt:Mixed self-assembled monolayers of azobenzene photoswitches with trifluoromethyl and cyano end groups,
 J. Phys.: Condens. Matter 24 (2012) 394015 ( DOI:10.1088/0953-8984/24/39/394015 )
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F. Ernst, T. Heek, A. Setaro, R. Haag, and S. Reich:Energy transfer in nanotube-perylene complexes,
 Adv. Funct. Mater. 22, 3921–3926 (2012) ( DOI:10.1002/adfm.201200784 )
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F. Ernst, T. Heek, R. Haag, S. Reich, and A. Setaro:Chirally enhanced solubilization through perylene-based surfactant,
 phs. stat. sol. (b) 249, 2465–2468 (2012) ( DOI:10.1002/pssb.201200192 )
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C. Kördel, A. Setaro, C. S. Popeney, P. Blümmel, S. Reich, R. Haag:Controlled reversible debundling of single-walled carbon nanotubes by photo-switchable dendritic surfactants,
 Nanoscale 4, 3029 – 3031 (2012) ( DOI:10.1039/C2NR30305A )
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C. S. Popeney, A. Setaro, R.-C. Mutihac, P. Bluemmel, B. Trappmann, J. Vonnemann, S. Reich, R. Haag: Polyglycerol-derived amphiphiles for the solubilization of single-walled carbon nanotubes in water: A structure-property study,
 ChemPhysChem 13, 203-211 (2012) ( DOI:10.1002/cphc.201100691 )
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K. Rück-Braun, K. Mayer, A. Hebert, F. Michalik:Fulgimides,
 in CRC Handbook of Organic Photochemistry and Photobiology (3rd Edition, Editors: A. Griesbeck, M. Oelgemoller, F. Ghetti), 1, 607-626 (2012) ( ISBN:978-1-43989-933-5 )
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L. Dworak, M. Zastrow, G. Zeyat, K. Rück-Braun, J. Wachtveitl:Ultrafast dynamics of dithienylethenes differently linked to the surface of TiO2 nanoparticles,
 J. Phys.: Condens. Matter 24, 394007 (2012) ( DOI:10.1088/0953-8984/24/39/394007 )
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S. Kuehn, S. Friede, M. Zastrow, C. Gahl, K. Rueck-Braun, T. Elsaesser:Photophysics of closed- and open-ring isomers of a diarylethene with a carboxylic anchor group,
 Chem. Phys. Lett. 542, 94-98 (2012)( DOI:10.1016/j.cplett.2012.05.077 )
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C. F. Hermanns, M. Bernien, A. Krüger, J. Miguel, and W. Kuch:Switching the electronic properties of Co-octaethylporphyrin molecules on oxygen-covered Ni films by NO adsorption,
 J. Phys.: Condens. Matter 24, 394008 (2012) ( DOI:10.1088/0953-8984/24/39/394008 )
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C. Bronner, F. Leyssner, S. Stremlau, M. Utecht, P. Saalfrank, T. Klamroth, P. Tegeder:Electronic structure of a sub-nanometer wide bottom-up fabricated graphene nanoribbon: end states, band gap and dispersion
 Phys. Rev. B, 86 (2012) 085444 ( DOI:10.1103/PhysRevB.86.085444 )
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Ch. Lotze, Y. Luo, M. Corso, K.J. Franke, R. Haag, J.I. Pascual:Reversible electron-induced cis-trans isomerization mediated by intermolecular interactions
 Journal of Physics: Condensed Matter (2012), accepted
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Y. Luo, M. Bernien, A. Krüger, C. F. Hermanns, J. Miguel, Y.-M. Chang, S. Jaekel, W. Kuch, and R. Haag:In-situ Hydrolysis of Imine Derivatives on Au(111) for the Formation of Aromatic Mixed Self-Assembled Monolayers: Multi-technique Analysis of This Tunable Surface Modification,
 Langmuir 28, 358 (2012) ( DOI:10.1021/la202696a )
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P. Tegeder:Optically and thermally induced molecular switching processes at metal surfaces,
 J. Phys.: Condens. Matter 24, 394001 (2012) (topical review)
 ( DOI:10.1088/0953-8984/24/39/394001 )
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C. Bronner, M. Schulze, S. Hagen, and P. Tegeder:The influence of the electronic structure of adsorbate-substrate complexes on the photoisomerization ability,
 New J. Phys., 14 (2012) 043032 (16pp) ( DOI:10.1088/1367-2630/14/4/043023 )
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E. Varene, L. Bogner, St. Meyer, Y. Pennec, and P. Tegeder:Coverage-dependent adsorption geometry of octithiophene on Au(111),
 Phys. Chem. Chem. Phys., 14, 691-696 (2012) ( DOI:10.1039/C1CP22875G )
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E. Alper Ünal, D. Wiedemann, J. Seiffert, J. P. Boyd, A. Grohmann:Efficient synthesis of pentakis- and tris(pyridine) ligands,
 Tetrahedron Letters 53, 54 (2012) (DOI:10.1016/j.tetlet.2011.10.131)
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| Projektbereich C: Theorie | 
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C. Bronner, F. Leyssner, S. Stremlau, M. Utecht, P. Saalfrank, T. Klamroth, P. Tegeder:Electronic structure of a sub-nanometer wide bottom-up fabricated graphene nanoribbon: end states, band gap and dispersion
 Phys. Rev. B, 86 (2012) 085444 ( DOI:10.1103/PhysRevB.86.085444 )
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C. Lotze, M. Corso, K. J. Franke, F. von Oppen, J.I. Pascual:Driving a macroscopic oscillator with the stochastic motion of a hydrogen molecule,
 Science 338, 779 (2012) (DOI:10.1126/science.1227621 )
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E. Malic, A. Setaro, P. Bluemmel, C. F. Sanz-Navarro, P. Ordejon, St. Reich, and A. Knorr:Carbon nanotubes as substrates for molecular spiropyran-based switches,
 J. Phys: Cond. Matter 24, 394006 (2012)( DOI: 10.1088/0953-8984/24/39/394006 )
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E. Bobkin, A. Knorr, and E. Malic:Exciton-phonon sidebands in metallic carbon nanotubes studied using semiconductor Bloch equations,
 Phys. Rev. B 85, 033409 (2012)( DOI: 10.1103/PhysRevB.85.033409 )
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O. A. Dyatlova, J. Gomis-Bresco, E. Malic, H. Telg, J. Maultzsch, G. Zhong, J. Geng, and U. Woggon:Dielectric screening effects on transition energies in aligned carbon nanotubes,
 Phys. Rev. B 85, 245449 (2012)( DOI: 10.1103/PhysRevB.85.245449 )
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M. Thomas, T. Karzig, S. Viola Kusminskiy, G. Zarand, F. von Oppen:Scattering theory of adiabatic reaction forces due to out-of-equilibrium quantum environments,
 Phys. Rev. B 86, 195419 (2012) ( DOI: 10.1103/PhysRevB.86.195419 )
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K. Zenichowski, Ch. Nacci, S. Fölsch, J. Dokic, T. Klamroth, P. Saalfrank:STM-switching of organic molecules on semiconductor surfaces: an above threshold density matrix model for 1,5 cyclooctadiene on Si(100),
 J. Phys.: Condens. Matter 24, 394009 (2012) ( DOI:10.1088/0953-8984/24/39/394009 )
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K. Zenichowski, J. Dokic, T. Klamroth, P. Saalfrank:Current versus temperature-induced switching of a single molecule: Open-system density matrix theory for 1,5-cyclooctadiene on Si(100),
 J. Chem. Phys. 136, 094705 (2012) ( DOI:10.1063/1.3692229 )
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G. Floss, G. Granucci, P. Saalfrank:Surface Hopping Dynamics of Direct Trans → Cis Photoswitching of an Azobenzene Derivative in Constrained Adsorbate Geometries,
 J. Chem. Phys. 137, 234701 (2012) ( DOI:10.1063/1.4769087 )
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O. A. Dyatlova, C. Köhler, E. Malic, J. Gomis-Bresco, J. Maultzsch, A. Tsagan-Mandzhiev, T. Watermann, A. Knorr, and U. Woggon:Ultrafast Relaxation Dynamics via Acoustic Phonons in Carbon Nanotubes,
 Nano Letters 12, 2249 (2012) ( DOI:10.1021/nl2043997 )
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N. Bode, E. Mariani, F. von Oppen:Transport properties of graphene functionalized with molecular switches,
 J. Phys.: Condens. Matter 24, 394017 (2012) ( DOI:10.1088/0953-8984/24/39/394017 )
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J. Brüggemann, G. Weick, F. Pistolesi, F. von Oppen:Large current noise in nanoelectromechanical systems close to continuous mechanical instabilities,
 Phys Rev. B 85, 125441 (2012) ( DOI:10.1103/PhysRevB.85.125441 )
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N. Bode, L. Arrachea, G.S. Lozano, T.S. Nunner, F. von Oppen:Current-induced switching in transport through anisotropic magnetic molecules
 Phys Rev. B 85, 115440 (2012) ( DOI:10.1103/PhysRevB.85.115440 )
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N. Bode, S. Viola Kusminskiy, R. Egger, F. von Oppen:Current-induced forces in mesoscopic systems: a scattering matrix approach
 Beilstein J. Nanotechnol. 3, 144 (2012) ( DOI:10.3762/bjnano.3.15 )
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