Publications 2009

Years

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These papers are ordered by article relevance.

Linear Continuum Mechanics for Quantum Many-Body Systems
Jianmin Tao, Xianlong Gao, G. Vignale, I.V. Tokatly
Physical Review Letters 103, 86401 (2009)
Renormalization of Molecular Quasiparticle Levels at Metal-Molecule Interfaces: Trends across Binding Regimes
K.S. Thygesen, A. Rubio
Physical Review Letters 102, 46802 (2009)
Customized Electronic Coupling in Self-Assembled Donor-Acceptor Nanostructures
D.G. de Oteyza, J.M. García-Lastra, M. Corso, B.P. Doyle, L. Floreano, A. Morgante, Y. Wakayama, A. Rubio, J. E. Ortega
Advanced Functional Materials 19, 3573 - 3567 (2009)
Long-Distance Proton Transfer with a Break in the Bacteriorhodopsin Active Site
P. Phatak, J. S. Frähmcke, M. Wanko, M. Hoffmann, P. Strodel, J. Smith, S. Suhai, A.-N. Bondar, M. Elstner
Journal Of The American Chemical Society 131, 7064 - 7078 (2009)
Fingerprints of bonding motifs in DNA duplexes of adenine and thymine revealed from circular dichroism: synchrotron radiation experiments and TDDFT calculations
L. Nielsen, A. Holm, D. Varsano, U. Kadhana, S. Hoffmann, R. Di Felice, A. Rubio, S. Nielsen
Journal Of Physical Chemistry B 113, 9614 - 9619 (2009)
Photo-excitation of a light-harvesting supra-molecular triad: a Time-Dependent DFT 
N. Spallanzani, C. A. Rozzi, D. Varsano, T. Baruah, M. R. Pederson, F. Manghi, A. Rubio
Journal Of Physical Chemistry B 113, 5345 - 5349 (2009)
Absorption spectra of p-Nitrophenolate Anions in Vacuo and in Solution
M-B.S. Kirketerp, M.A. Petersen, M. Wanko, L.A. Espinosa Leal, H. Zettergren, F.M. Raymo, A. Rubio, M. Brøndsted Nielsen, S. Brøndsted Nielsen
Chemphyschem 10, 1207 - 1209 (2009)
Angle-resolved photoemission study of the graphite intercalation compound KC8: A key to graphene
A. Grüneis, C. Attaccalite, A. Rubio, D.V. Vyalikh, S.L. Molodtsov, J. Fink, R. Follath, W. Eberhardt, B. Büchner,, T. Pichler
Physical Review B 80, 75431 (2009)
Overhauser’s spin-density wave in exact-exchange spin-density functional theory
S. Kurth, F.G. Eich
Physical Review B 80, 125120 (2009)
Phonon surface mapping of graphite: disentangling quasi–degenerate phonon dispersions.
A. Grüneis, J. Serrano, A. Bosak, M. Lazzeri, S.L. Molodtsov, L. Wirtz, C. Attaccalite, M. Krisch, A. Rubio, F. Mauri, T. Pichler
Physical Review B 80, 85423 (2009)
Polarization-induced renormalization of molecular levels at metallic and semiconducting surfaces
J.M. García-Lastra, C. Rostgaard, A. Rubio, K. S. Thygesen
Physical Review B 80, 245427 (2009)
Stochastic quantum molecular dynamics
Heiko Appel, Massimiliano Di Ventra
Physical Review B 80, 212303 (2009)
Color shift in Al2O3.xCr2O3 solid solutions and the electroneutrality principle
J.M García-Lastra, M.T. Barriuso, J.A. Aramburu, M.Moreno
Physical Review B 79, 241106 (2009)
Electronic structure and electron-phonon coupling of doped graphene layers in KC8
A. Grüneis, C. Attaccalite, A. Rubio, D. Vyalikh, S.L. Molodtsov, J. Fink, R. Follath, W. Eberhardt, B. Büchner, T. Pichler
Physical Review B 79, 205106 - 9 (2009)
Hot electron assisted femtochemistry at surfaces - A time-dependent density functional theory approach
J. Gavholt, A. Rubio, T. Olsen, K. Thygesen, J. Schiotz
Physical Review B 79, 195405 - 10 (2009)