Publications 2011
![https://carboquant.empa.ch/documents/55905/445901/Exohedral+Hydrogen+Chemisorption+on+a+Carbon+Nanotube+The+Clustering+Effect.jpg/5766f0f5-7148-4b9a-9b5c-18f9937cf7a1?t=1451983928000](https://carboquant.empa.ch/documents/55905/445901/Exohedral+Hydrogen+Chemisorption+on+a+Carbon+Nanotube+The+Clustering+Effect.jpg/5766f0f5-7148-4b9a-9b5c-18f9937cf7a1?t=1451983928000)
Exohedral Hydrogen Chemisorption on a Carbon Nanotube: Clustering Effect.
W. Andreoni, A. Curioni, J. M. H. Kroes, F. Pietrucci, O. Gröning
J. Phys. Chem. C 116, 269-275 (2011).
![https://carboquant.empa.ch/documents/55905/446755/Pseudomorphy%2C+surface+alloys+and+the+role+of+elementary+clusters+on+the+domain+orientations+in+the+Cu+Al13Co4+%28100%29+system.jpg/2c8d8d66-bb78-4487-806e-37249e9a3f21?t=1451984349000](https://carboquant.empa.ch/documents/55905/446755/Pseudomorphy%2C+surface+alloys+and+the+role+of+elementary+clusters+on+the+domain+orientations+in+the+Cu+Al13Co4+%28100%29+system.jpg/2c8d8d66-bb78-4487-806e-37249e9a3f21?t=1451984349000)
R. Addou, A. K. Shukla, M.-C. de Weerd, P. Gille, R. Widmer, O. Groening, V. Fournee, J.-M. Dubois, J. Ledieu
J. Phys.: Condens. Matter 23, 435009 (2011).
![https://carboquant.empa.ch/documents/55905/446755/Molecular+Bridges.jpg/bd4470ba-7cba-4be6-a1d5-97291b2dda67?t=1451989894000](https://carboquant.empa.ch/documents/55905/446755/Molecular+Bridges.jpg/bd4470ba-7cba-4be6-a1d5-97291b2dda67?t=1451989894000)
R. P. Berkelaar, H. Soede, T. F. Mocking, A. Kumar, B. Poelsema, H. J. W. Zandvliet
J. Phys. Chem. C 115, 2268 (2011).
![https://carboquant.empa.ch/documents/55905/446755/Free+energy+calculations+offer+insights+into+the+influence+of+receptor+flexibility+on+ligand%E2%80%93receptor+binding+affinities.jpg/45482ee4-40e2-4b23-bed4-fb6adf69afb9?t=1451990050000](https://carboquant.empa.ch/documents/55905/446755/Free+energy+calculations+offer+insights+into+the+influence+of+receptor+flexibility+on+ligand%E2%80%93receptor+binding+affinities.jpg/45482ee4-40e2-4b23-bed4-fb6adf69afb9?t=1451990050000)
J. Dolenc, S. Riniker, R. Gaspari, X. Daura, W. van Gunsteren
J. Comput. Aided Mol. Des. 25, 709 (2011).
![https://carboquant.empa.ch/documents/55905/446755/Lead+adsorption+on+the+Al13Co4+%28100%29+surface+heterogeneous+nucleation+and+pseudomorphic+growth.jpg/97c5d16b-aad1-4aea-8a8a-835beb0640e6?t=1451990297000](https://carboquant.empa.ch/documents/55905/446755/Lead+adsorption+on+the+Al13Co4+%28100%29+surface+heterogeneous+nucleation+and+pseudomorphic+growth.jpg/97c5d16b-aad1-4aea-8a8a-835beb0640e6?t=1451990297000)
Lead adsorption on the Al12Co4 (100) surface: heterogeneous nucleation and pseudomorphic growth.
R. Addou, A. K. Shukla, S. Alarcon Villaseca, E. Gaudry, Th. Deniozou, M. Heggen, M. Feuerbacher, R. Widmer, O. Gröning, V. Fournee, J.-M. Dubois, J. Ledieu
New J. Phys. 13, 103011 (2011).
![https://carboquant.empa.ch/documents/55905/446755/Supramolecular+Engineering+through+Temperature-Induced+Chemical+Modification+of+2H-Tetraphenylporphyrin+on+Ag+%28111%29+Flat+Phenyl+Conformation+and+Possible+Dehydrogenation+Reactions.jpg/35a6a93a-d78d-427c-8d8f-502965e1ac7d?t=1451990515000](https://carboquant.empa.ch/documents/55905/446755/Supramolecular+Engineering+through+Temperature-Induced+Chemical+Modification+of+2H-Tetraphenylporphyrin+on+Ag+%28111%29+Flat+Phenyl+Conformation+and+Possible+Dehydrogenation+Reactions.jpg/35a6a93a-d78d-427c-8d8f-502965e1ac7d?t=1451990515000)
G. Di Santo, S. Blankenburg, C. Castelarin-Cudia, M. Fanetti, P. Borghetti, L. Sangalletti, L. Floreano, A. Verdini, E. Magnano, F. Bondino, C. A. Pignedoli, M.-T. Nguyen, R. Gaspari, D. Passerone, A. Goldoni
Chem. Eur. J. 17, 14354 (2011).
![https://carboquant.empa.ch/documents/55905/446755/Soft+plasma+processing+of+organic+nanowires+a+route+for+the+fabrication+of+1D+organic+heterostructures+and+the+template+synthesis+of+inorganic+1D+nanostructures.jpg/6278f683-704f-460a-9372-03e6206eb8b9?t=1451990671000](https://carboquant.empa.ch/documents/55905/446755/Soft+plasma+processing+of+organic+nanowires+a+route+for+the+fabrication+of+1D+organic+heterostructures+and+the+template+synthesis+of+inorganic+1D+nanostructures.jpg/6278f683-704f-460a-9372-03e6206eb8b9?t=1451990671000)
M. Alcaire, J. R. Sanchez-Valencia, F. J. Aparicio, Z. Saghi, J. C. Gonzales-Gonzales, A. Barranco, Y. O. Zian, A. R. Gonzales-Elipe, P. Midgley, J. P. Espinos, P. Groening, A. Borras
Nanoscale 3, 4554 (2011).
![https://carboquant.empa.ch/documents/55905/446755/Self-Assembly+and+Two-Dimensional+Spontaneous+Resolution+of+Cyano-Functionalized+%5B7%5D+Helicenes+on+Cu+%28111%29.jpg/3945aa6d-610e-4004-9d3d-b6d5e423a985?t=1451990794000](https://carboquant.empa.ch/documents/55905/446755/Self-Assembly+and+Two-Dimensional+Spontaneous+Resolution+of+Cyano-Functionalized+%5B7%5D+Helicenes+on+Cu+%28111%29.jpg/3945aa6d-610e-4004-9d3d-b6d5e423a985?t=1451990794000)
M. Stoehr, S. Boz, M. Schaer, M.-T. Nguyen, C. A. Pignedoli, D. Passerone, W. B. Schweizer, C. A. Thilgen, T. A. Jung, F. Diederich
Angew. Chem. 50, 9982 (2011).
![https://carboquant.empa.ch/documents/55905/446755/s-orbital+continuum+model+accounting+for+the+tip+shape+in+simulated+scanning+tunneling+microscope+images.jpg/a6fc22ec-27c5-4786-b84a-c80e0913250f?t=1451991280000](https://carboquant.empa.ch/documents/55905/446755/s-orbital+continuum+model+accounting+for+the+tip+shape+in+simulated+scanning+tunneling+microscope+images.jpg/a6fc22ec-27c5-4786-b84a-c80e0913250f?t=1451991280000)
R. Gaspari, S. Blankenburg, C. A. Pignedoli, P. Ruffieux, M. Treier, R. Fasel, D. Passerone
Phys. Rev. B 84, 125417 (2011).
![https://carboquant.empa.ch/documents/55905/446755/Surface-supported+2D+heterotriangulene+polymers.jpg/09989596-669a-45c3-b293-1fbf17c36c2e?t=1451991453000](https://carboquant.empa.ch/documents/55905/446755/Surface-supported+2D+heterotriangulene+polymers.jpg/09989596-669a-45c3-b293-1fbf17c36c2e?t=1451991453000)
Surface-supported 2D heterotriangulene polymers
M. Bieri, S. Blankenburg, M. Kivala, C. A. Pignedoli, P. Ruffieux, K. Müllen, R. Fasel
Chem. Commun. 47, 10239 (2011).
![https://carboquant.empa.ch/documents/55905/446755/Subphthalocyanine-based+nanocrystals.jpg/f401dcfc-8666-47d1-8e58-b351c67a214e?t=1451991620000](https://carboquant.empa.ch/documents/55905/446755/Subphthalocyanine-based+nanocrystals.jpg/f401dcfc-8666-47d1-8e58-b351c67a214e?t=1451991620000)
Subphthalocyanine-based nanocrystals
M. Trelka, A. Medina, D. Écija, C. Urban, O. Gröning, R. Fasel, J. M. Gallego, C. G. Claessens, R. Otero, T. Torres, R. Miranda
Chem. Commun. 47, 9986 (2011)
![https://carboquant.empa.ch/documents/55905/446755/Evolution+of+the+Rashba+spin-orbit-split+Shockley+state+on+Ag+Pt+%28111%29.jpg/2323d123-c086-41a3-8407-8a3e25cee6f9?t=1451991796000](https://carboquant.empa.ch/documents/55905/446755/Evolution+of+the+Rashba+spin-orbit-split+Shockley+state+on+Ag+Pt+%28111%29.jpg/2323d123-c086-41a3-8407-8a3e25cee6f9?t=1451991796000)
Evolution of the Rashba spin-orbit-split Shockley state on Ag/Pt(111).
A. Bendounan, K. Aït-Mansour, J. Braun, J. Minár, S. Bornemann, R. Fasel, O. Gröning, F. Sirotti, H. Ebert
Phys. Rev. B 83, 195427 (2011)
![https://carboquant.empa.ch/documents/55905/446755/Defect-induced+multicomponent+electron+scattering+in+single-walled+carbon+nanotubes.jpg/23e55347-6089-41c8-8665-7e2a918c0853?t=1451991961000](https://carboquant.empa.ch/documents/55905/446755/Defect-induced+multicomponent+electron+scattering+in+single-walled+carbon+nanotubes.jpg/23e55347-6089-41c8-8665-7e2a918c0853?t=1451991961000)
Defect-induced multicomponent electron scattering in single-walled carbon nanotubes.
D. Bercioux, G. Buchs, H. Grabert, O. Gröning
Phys. Rev. B 83, 165439 (2011)
![https://carboquant.empa.ch/documents/55905/446755/Complex+Interplay+and+Hierarchy+of+Interactions+in+Two-Dimensional+Supramolecular+Assemblies.jpg/1aa42763-39ea-4d50-973b-556d0944aad8?t=1451992140000](https://carboquant.empa.ch/documents/55905/446755/Complex+Interplay+and+Hierarchy+of+Interactions+in+Two-Dimensional+Supramolecular+Assemblies.jpg/1aa42763-39ea-4d50-973b-556d0944aad8?t=1451992140000)
Complex interplay and hierarchy of interactions in two-dimensional supramolecular assemblies.
M. E. Cañas-Ventura, K. Aït-Mansour, P. Ruffieux, R. Rieger, K. Müllen, H. Brune, R. Fasel
ACS Nano 5, 457 (2011)
![https://carboquant.empa.ch/documents/55905/446755/Encapsulated+Inorganic+Nanostructures+A+Route+to+Sizable+Modulated+Noncovalent+On-Tube+Potentials+in+Carbon+Nanotubes.jpg/119bffef-a70b-4e30-8675-2c23b679df0b?t=1451992320000](https://carboquant.empa.ch/documents/55905/446755/Encapsulated+Inorganic+Nanostructures+A+Route+to+Sizable+Modulated+Noncovalent+On-Tube+Potentials+in+Carbon+Nanotubes.jpg/119bffef-a70b-4e30-8675-2c23b679df0b?t=1451992320000)
A. Ilie, J. S. Bendall, K. Nagaoka, S. Egger, T. Nakayama, S. Crampin
ACS Nano 5, 2559 (2011)
![https://carboquant.empa.ch/documents/55905/446755/An+ab+initio+insight+into+the+Cu%28111%29+-+mediated+Ullmann+reaction.jpg/98568042-7b4d-4676-b4ef-c6498297b7b9?t=1451992510000](https://carboquant.empa.ch/documents/55905/446755/An+ab+initio+insight+into+the+Cu%28111%29+-+mediated+Ullmann+reaction.jpg/98568042-7b4d-4676-b4ef-c6498297b7b9?t=1451992510000)
An ab initio insight into the Cu(111)-mediated Ullmann reaction.
M. T. Nguyen, C. A. Pignedoli, D. Passerone
Phys. Chem. Chem. Phys. 13, 154 (2011)
![https://carboquant.empa.ch/documents/55905/446755/Two-Dimensional+Self-Assembly+of+Chiral+Malic+Acid+on+Cu+%28110%29.jpg/64af356d-6d08-49f0-8286-425301418c0e?t=1451992687000](https://carboquant.empa.ch/documents/55905/446755/Two-Dimensional+Self-Assembly+of+Chiral+Malic+Acid+on+Cu+%28110%29.jpg/64af356d-6d08-49f0-8286-425301418c0e?t=1451992687000)
Two-dimensional self-assembly of chiral malic acid on Cu(110)
C. Roth, D. Passerone, L. Merz, M. Parschau, K.-H. Ernst
J. Phys. Chem. C 115, 1240 (2011)
![https://carboquant.empa.ch/documents/55905/446755/Methane+adsorption+on+graphene+from+first+principles+including+dispersion+interaction.jpg/5cf768e0-9303-4ee6-9b80-1c08ea93e73d?t=1451992816000](https://carboquant.empa.ch/documents/55905/446755/Methane+adsorption+on+graphene+from+first+principles+including+dispersion+interaction.jpg/5cf768e0-9303-4ee6-9b80-1c08ea93e73d?t=1451992816000)
Methane adsorption on graphene from first principles including dispersion interaction
C. Thierfelder, M. Witte, S. Blankenburg, E. Rauls, W. G. Schmidt
Surf. Sci. 605, 746 (2011)
![https://carboquant.empa.ch/documents/55905/446755/Surface-assisted+cyclodehydrogenation+provides+a+synthetic+route+towards+easily+processable+and+chemically+tailored+nanographenes.jpg/6c57a7e3-c587-4a23-b557-0474e68c39c8?t=1451993015000](https://carboquant.empa.ch/documents/55905/446755/Surface-assisted+cyclodehydrogenation+provides+a+synthetic+route+towards+easily+processable+and+chemically+tailored+nanographenes.jpg/6c57a7e3-c587-4a23-b557-0474e68c39c8?t=1451993015000)
M. Treier, C. A. Pignedoli, T. Laino, R. Rieger, K. Müllen, D. Passerone, R. Fasel
Nature Chemistry 3, 61 (2011)