Prof. Angel Rubio - Publications

Years

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These papers are ordered by article relevance. This list contains only the publications related to the Nano-bio Spectroscopy Group and might not be the complete list of the author.

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)
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)
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)
Potassium intercalated single-wall carbon nanotube bundles: Archetypes for semiconductor/metal hybrid systems
C. Kramberger, H. Rauf, M. Knupfer, H. Shiozawa, D. Batchelor, A. Rubio, H. Kataura, T. Pichler
Physical Review B 75, 195442 - 5 (2009)
Hydrogenation of C-60 in Peapods: Physical Chemistry in Nano Vessels
E. Abou-Hamad, Y. Kim, A.V. Talyzin, C. Goze, D.E. Luzzi, A. Rubio, T. Wagberg
Journal Of Physical Chemistry C 113, 8583 - 8587 (2009)
A dynamic landscape from femtoseconds to minutes for electron solvation at ice-metal interfaces
U. Bovensiepen, C. Gahl, J. Stähler, M. Bockstedte, F. Baletto, S. Scandolo, X.-Y. Zhu, A. Rubio, M. Wolf
Journal Of Physical Chemistry C 113, 979 - 988 (2009)
Time dependent density functional theory
A. Rubio, M.A.L. Marques
Physical Chemistry Chemical Physics 11, 4436 (2009)
Towards a gauge invariant method for molecular chiroptical properties in TDDFT
D. Varsano, L.A. Espinosa Leal, X. Andrade, M.A.L. Marques, R. di Felice, A. Rubio
Physical Chemistry Chemical Physics 11, 4481 - 4489 (2009)
The challenge of predicting optical properties of biomolecules: what can we learn from time-dependent density-functional theory
A. Castro, M.A.L. Marques, D. Varsano, F. Sottile, A. Rubio
Comptes Rendus Physique 10, 469 - 490 (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)
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)
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)
Density matrix theory for the ground state of spin-compensated harmonically confined two-electron model atoms with general interparticle repulsion
Ali Akbari, Norman H. March, Angel Rubio
Physical Review A 80, 32509 - 32518 (2009)
Photoabsorption spectra of small cationic xenon clusters from time-dependent density functional theory
M.J.T. Oliveira, F. Nogueira, M.A.L. Marques, A. Rubio
Journal of Chemical Physics 131, 214302 (2009)
Exact Kohn–Sham potential of strongly correlated finite systems
Helbig, N., Tokatly, I.V., Rubio, A.
Journal of Chemical Physics 131, 224105 (2009)