Publications

2020

A. Calloni, M. Jagadeesh, G. Bussetti, G. Fratesi, S. Achilli, A. Picone, A. Lodesani, A. Brambilla, C. Goletti, F. Ciccacci, L. Duo, M. Finazzi, A. Goldoni, A. Verdini, L. Floreano; Cobalt atoms drive the anchoring of Co-TPP molecules to the oxygen-passivated Fe(001) surface, APPLIED SURFACE SCIENCE 505, 144213. 10.1016/j.apsusc.2019.144213
Nicolas Tancogne-Dejean, Micael Oliveira, Xavier Andrade, Heiko Appel, Carlos Borca, Guillaume Le Breton, Florian Buchholz, Alberto Castro, Stefano Corni, Alfredo Correa, Umberto De Giovannini, Alain Delgado, Florian Bich, Johannes Flick, Gabriel Gil, Adrian Gomez, Nicole Helbig, Hannes Huebener, Rene Jestaedt, Joaquim Jornet-Somoza, Ask Larsen, Lebedeva V, Irina, Martin Lueders, Miguel Marques, Sebastian Ohlmann, Silvio Pipolo, Markus Rampp, Carlo Rozzi, David Strubbe, Shunsuke Sato, Christian Schaefer, Iris Theophilou, Alicia Welden, Angel Rubio; Octopus, a computational framework for exploring light-driven phenomena and quantum dynamics in extended and finite systems, JOURNAL OF CHEMICAL PHYSICS 152, 124119. 10.1063/1.5142502
Alexander Riss, Marcus Richter, Alejandro Paz, Xiao-Ye Wang, Rajesh Raju, Yuanqin He, Jacob Ducke, Eduardo Corral, Michael Wuttke, Knud Seufert, Manuela Garnica, Angel Rubio, Johannes Barth, Akimitsu Narita, Klaus Muellen, Reinhard Berger, Xinliang Feng, Carlos-Andres Palma, Willi Auwaerter; Polycyclic aromatic chains on metals and insulating layers by repetitive [3+2] cycloadditions, NATURE COMMUNICATIONS 1110.1038/s41467-020-15210-2
Irene Toranzo, David Puertas-Centeno, Nahual Sobrino, Jesus Dehesa; Analytical Shannon information entropies for all discrete multidimensional hydrogenic states, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 120, e26077. 10.1002/qua.26077
Jing Li, Ivan Duchemin, Xavier Blase, Valerio Olevano; Ground-state correlation energy of beryllium dimer by the Bethe-Salpeter equation, SCIPOST PHYSICS 8, 020. 10.21468/SciPostPhys.8.2.020
Felix Otto, Tino Kirchhuebel, Anu Baby, Falko Sojka, Guido Fratesi, Torsten Fritz, Roman Forker; High Potassium Concentrations Nested in Epitaxial Monolayers of a Flexible Lander-Type Molecule on Ag(111), JOURNAL OF PHYSICAL CHEMISTRY C 124, 4114-4127. 10.1021/acs.ipcc.9b10560
Ilya Piskun, Raymond Blackwell, Joaquim Jornet-Somoza, Fangzhou Zhao, Angel Rubio, Steven Louie, Felix Fischer; Covalent C-N Bond Formation through a Surface Catalyzed Thermal Cyclodehydrogenation, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 142, 3696-3700. 10.1021/jacs.9b13507
Elena Molteni, Giancarlo Cappellini, Roberto Cardia, Giovanni Onida, Guido Mula; Eumelanin Adsorption on Silicon: Optical Properties of Si(001)-Adsorbed Eumelanin Tetrameric Protomolecules, JOURNAL OF PHYSICAL CHEMISTRY C 124, 9376-9384. 10.1021/acs.jpcc.0c01293
A. Ugolotti, G. Brivio, Guido Fratesi; Coverage-dependent electronic and optical properties of H- or F-passivated Si/Ag(111) from first principles, PHYSICAL REVIEW B 101, 195413. 10.1103/PhysRevB.101.195413
Rajarshi Sinha-Roy, Pablo Garcia-Gonzalez, Hans-Christian Weissker; How metallic are noble-metal clusters? Static screening and polarizability in quantum-sized silver and gold nanoparticles, NANOSCALE 12, 4452-4458. 10.1039/c9nr08608k

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