Publications 2013

Simulation+of+Adsorption+Processes+at+Metallic+Interfaces+An+Image+Charge+Augmented+QM+MM+Approach.jpg

Simulation of Adsorption Processes at Metallic Interfaces: An Image Charge Augmented QM/MM Approach

D. Golze, M. Iannuzzi, M.-T. Nguyen, D. Passerone, J. Hutter

J. Chem. Theory Comput. 9, 5086 (2013).

Chemistry+and+temperature-assisted+dehydrogenation+of+C60H30+molecules+on+TiO2%28110%29+surfaces.jpg

Chemistry and temperature-assisted dehydrogenation of C60H30 molecules on TiO2(110) surfaces

C. Sánchez-Sánchez, J. I. Martínez, V. Lanzilotto, G. Biddau, B. Gómez-Lor, R. Pérez, L. Floreano, M. F. Lópeza, J. A. Martín-Gago

Nanoscale 5, 11058 (2013).

Chirality+Transfer+in+1D+Self-Assemblies+Influence+of+H-Bonding+vs+Metal+Coordination+between+Dicyano%5B7%5Dhelicene+Enantiomers.jpg

Chirality Transfer in 1D Self-Assemblies: Influence of H-Bonding vs Metal Coordination between Dicyano[7]helicene Enantiomers

A. Shchyrba, M.-T. Nguyen, C. Wäckerlin, S. Martens, S. Nowakowska, T. Ivas, J. Roose, T. Nijs, S. Boz, M. Schär, M. Stöhr, C. A. Pignedoli, C. Thilgen, F. Diederich, D. Passerone, T. A. Jung

J. Am. Chem. Soc. 135, 15270 (2013).

Modulation+of+charge+transport+properties+of+reduced+graphene+oxide+by+submonolayer+physisorption+of+an+organic+dye.jpg

Modulation of charge transport properties of reduced graphene oxide by submonolayer physisorption of an organic dye

S. R. Pathipati, E. Pavlica, E. Treossi, R. Rizzoli, G. P. Veronese, V. Palermo, L. Chen, D. Beljonne, J. Cai, R. Fasel, P. Ruffieux, G. Bratina

Organic Electronics 14, 1787 (2013).

Atomic+Oxygen+Chemisorption+on+Carbon+Nanotubes+Revisited+with+Theory+and+Experiment.jpg

Atomic Oxygen Chemisorption on Carbon Nanotubes Revisited with Theory and Experiment

J. M. H. Kroes, F. Pietrucci, A. Curioni, R. Jaafar, O. Groening, W. Andreoni

J. Phys. Chem. C 117, 1948 (2013).

Adsorption+and+Friction+Behavior+of+Amphiphilic+Polymers+on+Hydrophobic+Surfaces.jpg

Adsorption and Friction Behavior of Amphiphilic Polymers on Hydrophobic Surfaces

G. Fontani, R. Gaspari, N. D. Spencer, D. Passerone, R. Crockett

Langmuir 29, 4760 (2013).

Role+of+the+Anchored+Groups+in+the+Bonding+and+Self-Organization+of+Macrocycles+Carboxylic+versus+Pyrrole+Groups.jpg

Role of the Anchored Groups in the Bonding and Self-Organization of Macrocycles: Carboxylic versus Pyrrole Groups

R. González-Moreno, A. Garcia-Lekue, A. Arnau, M. Trelka, J. M. Gallego, R. Otero, A. Verdini, C. Sánchez-Sánchez, P. L. de Andrés, J. A. Martín-Gago, C. Rogero

J. Phys. Chem C 117, 7661 (2013).

%CF%80-Conjugated+Heterotriangulene+Macrocycles+by+Solution+and+Surface-supported+Synthesis+toward+Honeycomb+Networks.jpg

π-Conjugated Heterotriangulene Macrocycles by Solution and Surface-supported Synthesis toward Honeycomb Networks

F. Schluetter, F. Rossel, M. Kivala, V. Enkelmann, J.-P. Gisselbrecht, P. Ruffieux, R. Fasel, K. Müllen

J. Am. Soc. 135, 4550 (2013).

Structural+investigation+of+Pb+adsorption+on+the+%28010%29+surface+of+the+orthorhombic+T-Al3%28Mn+Pd%29+crystal.jpg

Structural investigation of Pb adsorption on the (010) surface of the orthorhombic T-Al3(Mn,Pd) crystal

R. Addoua, A. K. Shukla, Th. Deniozou, M. Heggen, M. Feuerbacher, O. Groening, V. Fournée, J.-M. Dubois, J. Ledieu

Surf. Sci. 611, 74 (2013).

Epilayer+thickness+and+strain+dependence+of+Ge+113+surface+energies.jpg

Epilayer thickness and strain dependence of Ge(113) surface energies

D. Scopece, M. J. Beck

Phys. Rev. B 87, 155310 (2013).

Correlating+scanning+tunneling+spectroscopy+with+the+electrical+resistivity+of+Al-based+quasicrystals+and+approximants.jpg

Correlating scanning tunneling spectroscopy with the electrical resistivity of Al-based quasicrystals and approximants

R. Maeder, R. Widmer, P. Gröning, W. Steurer, O. Gröning

Phys. Rev. B 87, 075425 (2013).

Termini+of+Bottom-Up+Fabricated+Graphene+Nanoribbons.jpg

Termini of Bottom-Up Fabricated Graphene Nanoribbons

L. Talirz, H. Soede, J. Cai, P. Ruffieux, S. Blankenburg, R. Jafaar, R. Berger, X. Feng, K. Muellen, D. Passerone, R. Fasel, C.A. Pignedoli

J. Am. Chem. Soc. 135, 2060 (2013).

High-temperature+processable+carbon%E2%80%93silicate+nanocomposite+cold+electron+cathodes+for+miniature+X-ray+sources.jpg

High-temperature processable carbon–silicate nanocomposite cold electron cathodes for miniature X-ray sources

R. Longtin, H.-R. Elsener, J. R. Sanchez-Valencia, D. Cloetta, L.-O. Nilsson, C. Leinenbach, O. Gröning, P. Gröning

J. Mater. Chem. C 1, 1368 (2013).

High-pressure+lubricity+at+the+meso-+and+nanoscale.jpg

High-pressure lubricity at the meso- and nanoscale

A. Vanossi, A. Benassi, N. Varini, E. Tosatti

Phys. Rev. B 87, 045412 (2013).


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