Publications 2017


Result pages: ‹ previous 1 2 next ›

These papers are ordered by article relevance.

Creating stable Floquet-Weyl semimetals by laser-driving of 3D Dirac materials
Hannes Hübener, Michael A. Sentef, Umberto De Giovannini, Alexander F. Kemper, Angel Rubio
Nature Communications 8, 13940 (2017)
Atoms and Molecules in Cavities: From Weak to Strong Coupling in QED Chemistry
Johannes Flick,Michael Ruggenthaler,Heiko Appel, Angel Rubio
Proceedings Of The National Academy Of Sciences Of The United States Of America 114, 3026 - 3034 (2017)
Impact of the electronic band structure in high-harmonic generation spectra of solids
Nicolas Tancogne-Dejean, Oliver D. Mücke, Franz X. Kärtner, Angel Rubio
Physical Review Letters 118, 087403 (2017)
Bimodal supramolecular functionalization of carbon nanotubes triggered by covalent bond formation
Sofía Leret,Yann Pouillon,Santiago Casado,Cristina Navio,Angel Rubio, Emilio M. Pérez
Chemical Science 8, 1927 - 1935 (2017)
Strain induced bang-gap engineering in layered TiS3
Robert Biele, Eduardo Flores, Jose Ramón Ares, Carlos Sanchez, Isabel J. Ferrer, Gabino Rubio-Bollinger, Andres Castellanos-Gomez, Roberto D'Agosta
Nano Research accepted, (2017)
A first principles TDDFT framework for spin and time-resolved ARPES in periodic systems
Umberto De Giovannini, Hannes Hübener, Angel Rubio
Journal Of Chemical Theory And Computation 13 (1), 265 - 273 (2017)
Covalent modification of highly ordered pyrolytic graphite with a stable organic free radical using diazonium chemistry
Gonca Seber, Alexander V. Rudnev, Andrea Droghetti, Ivan Rungger, Jaume Veciana, Marta Mas-Torrent, Concepcio Rovira, Nuria Crivillers
Chemistry-A European Journal 23, 1415 (2017)
h-AlN-Mg(OH)2 vdW Bilayer Heterostructure: Tuning the excitonic characteristics
C. Bacaksiz,A. Dominguez,A. Rubio,R. T. Senger,, H. Sahin
Physical Review B 95, 075423 (2017)
Quantum transport simulation scheme including strong correlations and its application to organic radicals adsorbed on gold
Andrea Droghetti, Ivan Rungger
Physical Review B 95, 085131 (2017)
Electronic Non-adiabatic Dynamics in Enhanced Ionization of Isotopologues of H2+ from the Exact Factorization Perspective
Elham Khosravi, Ali Abedi, Angel Rubio, Neepa T. Maitra
Physical Chemistry Chemical Physics 19, 8269 - 8281 (2017)
Custom Coordination Environments for Lanthanoids: Tripodal Ligands Achieve Near-Perfect Octahedral Coordination for Two Dysprosium-Based Molecular Nanomagnets
Kwang Soo Lim, José J. Baldoví, ShangDa Jiang, Bong Ho Koo, Dong Won Kang, Woo Ram Lee, Eui Kwan Koh, Alejandro Gaita-Ariño, Eugenio Coronado, Michael Slota, Lapo Bogani,, Chang Seop Hong
Inorganic Chemistry 56 (9), 4911 - 4917 (2017)
Electronic Structure and Magnetic Anisotropy in Lanthanoid SingleIon Magnets with C3 Symmetry: The Ln(trenovan) Series
Eva Lucaccini, José J. Baldoví,* Laura Chelazzi, Anne-Laure Barra, Fabrizia Grepioni, Jean-Pierre Costes,, Lorenzo Sorace*
Inorganic Chemistry 56, 4728 - 4738 (2017)
Emergent elemental two-dimensional materials beyond graphene
Yuanbo Zhang,Angel Rubio, Guy Le Lay
Journal Of Physics D-Applied Physics 50, 053004 (11pp) (2017)
The atomic simulation environment—a Python library for working with atoms
Ask Hjorth Larsen, Jens Jørgen Mortensen, Jakob Blomqvist, Ivano E Castelli, Rune Christensen, Marcin Dułak, Jesper Friis, Michael N Groves, Bjørk Hammer, Cory Hargus, Eric D Hermes, Paul C Jennings, Peter Bjerre Jensen, James Kermode, John R Kitchin, Esben Leonhard Kolsbjerg, Joseph Kubal, Kristen Kaasbjerg, Steen Lysgaard, Jón Bergmann Maronsson, Tristan Maxson, Thomas Olsen, Lars Pastewka, Andrew Peterson, Carsten Rostgaard, Jakob Schiøtz, Ole Schütt, Mikkel Strange, Kristian S Thygesen, Tejs Vegge, Lasse Vilhelmsen, Michael Walter, Zhenhua Zeng, Karsten W Jacobsen
Journal Of Physics-Condensed Matter 29, 273002 (2017)
libvdwxc: a library for exchange–correlation functionals in the vdW-DF family
Ask Hjorth Larsen, Mikael Kuisma, Joakim Löfgren, Yann Pouillon, Paul Erhart, Per Hyldgaard
Modelling And Simulation In Materials Science And Engineering 25, 065004 (2017)