Publications: Foundations of Time-dependent Density Functional Theory


These papers are ordered by article relevance.

Spectroscopy of Nitrophenolates in Vacuo: Effect of Spacer,Configuration, and Microsolvation on the Charge-Transfer Excitation Energy
Steen Brøndsted Nielsen,Mogens Brøndsted Nielsen, Angel Rubio
Accounts Of Chemical Research 47, 1417 - 1425 (2014)
Photo-induced C-C reactions on insulators towards photolithography of graphene nanoarchitectures
Carlos-Andres Palma, Katharina Diller, Reinhard Berger, Alexander Welle, Jonas Björk, Jose Luis Cabellos, Duncan J. Mowbray, Anthoula C. Papageorgiou, Natalia P. Ivleva, Sonja Matich, Emanuela Margapoti, Reinhard Niessner, Bernhard Menges, Joachim Reichert, XinLiang Feng, Hans Joachim Räder, Florian Klappenberger, Angel Rubio, Klaus Müllen, Johannes V. Barth
Journal Of The American Chemical Society 136, 4651 - 4658 (2014)
Correlated electron-nuclear dynamics with conditional wave functions
Guillermo Albareda, Heiko Appel, Ignacio Franco, Ali Abedi,, Angel Rubio
Physical Review Letters 113, 083003 (5 pp.) (2014)
Quantum electrodynamical time-dependent density-functional theory for many-electron systems on a lattice
Mehdi Farzanehpour, I. V. Tokatly
Physical Review B 90, 195149 (2014)
Quantum-electrodynamical density-functional theory: Bridging quantum optics and electronic-structure theory
Michael Ruggenthaler, Johannes Flick, Camilla Pellegrini, Heiko Appel, Ilya V. Tokatly,, Angel Rubio
Physical Review A 90, 012508 (2014)
Local reduced-density-matrix-functional theory: Incorporating static correlation effects in Kohn-Sham equations
N.N. Lathiotakis, N. Helbig, A. Rubio, N. I. Gidopoulos
Physical Review A 90, 032511 (2014)
Time-Dependent Density-Functional Theory of Strong-Field Ionization of Atoms under Soft X-Rays
A. Crawford-Uranga, U. De Giovannini, E. Räsänen, M. J. T. Oliveira, D. J. Mowbray, G. M. Nikolopoulos, E. T. Karamatskos, D. Markellos, P. Lambropoulos, S. Kurth, A. Rubio
Physical Review A 90, 033412 (2014)
Modelling the effect of nuclear motion on the attosecond time-resolved photoelectron spectra of ethylene
A. Crawford-Uranga, U. De Giovannini, D. J. Mowbray, S. Kurth, A. Rubio
Journal of Physics B: Atomic Molecular and Optical Physics 47, 124018 (2014)
PFO-BPy Solubilizers for SWNTs: Modelling Polymers from Oligomers
Livia Noemi Glanzmann, Duncan J. Mowbray, Angel Rubio
Physica Status Solidi B 251, 2407 - 2412 (2014)
Theoretical electron energy loss spectroscopy of isolated graphene
Duncan J. Mowbray
Physica Status Solidi B 251, 2509 - 2514 (2014)