Alberto Castro
Alberto Castro
ARAID Foundation and Institute for Biocomputation and Physics of Complex Systems, University of
Verified email at bifi.es - Homepage
TitleCited byYear
octopus: a first-principles tool for excited electron–ion dynamics
MAL Marques, A Castro, GF Bertsch, A Rubio
Computer Physics Communications 151 (1), 60-78, 2003
6632003
octopus: a tool for the application of time‐dependent density functional theory
A Castro, H Appel, M Oliveira, CA Rozzi, X Andrade, F Lorenzen, ...
physica status solidi (b) 243 (11), 2465-2488, 2006
6482006
Propagators for the time-dependent Kohn–Sham equations
A Castro, MAL Marques, A Rubio
The Journal of chemical physics 121 (8), 3425-3433, 2004
4462004
Real-space grids and the Octopus code as tools for the development of new simulation approaches for electronic systems
X Andrade, D Strubbe, U De Giovannini, AH Larsen, MJT Oliveira, ...
Physical Chemistry Chemical Physics 17 (47), 31371-31396, 2015
2382015
Time-dependent density-functional approach for biological chromophores: the case of the green fluorescent protein
MAL Marques, X López, D Varsano, A Castro, A Rubio
Physical review letters 90 (25), 258101, 2003
2182003
Time-dependent density-functional theory in massively parallel computer architectures: the octopus project
X Andrade, J Alberdi-Rodriguez, DA Strubbe, MJT Oliveira, F Nogueira, ...
Journal of Physics: Condensed Matter 24 (23), 233202, 2012
2042012
TDDFT in massively parallel computer architectures: The OCTOPUS project
X Andrade, J Alberdi-Rodriguez, DA Strubbe, MJT Oliveira, F Nogueira, ...
Psi-k Scientific Highlights (highlight of the month) April 7 (8), 2012
204*2012
Alignment-dependent ionization of N 2, O 2, and CO 2 in intense laser fields
S Petretti, YV Vanne, A Saenz, A Castro, P Decleva
Physical review letters 104 (22), 223001, 2010
1532010
Assessment of exchange-correlation functionals for the calculation of dynamical properties of small clusters in time-dependent density functional theory
MAL Marques, A Castro, A Rubio
The Journal of Chemical Physics 115 (7), 3006-3014, 2001
1362001
Excited states dynamics in time-dependent density functional theory
A Castro, MAL Marques, JA Alonso, GF Bertsch, A Rubio
The European Physical Journal D-Atomic, Molecular, Optical and Plasma …, 2004
1342004
Single-active-electron approximation for describing molecules in ultrashort laser pulses and its application to molecular hydrogen
M Awasthi, YV Vanne, A Saenz, A Castro, P Decleva
Physical Review A 77 (6), 063403, 2008
1132008
Modified Ehrenfest formalism for efficient large-scale ab initio molecular dynamics
X Andrade, A Castro, D Zueco, JL Alonso, P Echenique, F Falceto, ...
Journal of Chemical Theory and Computation 5 (4), 728-742, 2009
1062009
Optimal control of quantum rings by terahertz laser pulses
E Räsänen, A Castro, J Werschnik, A Rubio, EKU Gross
Physical review letters 98 (15), 157404, 2007
1062007
Optical absorption of the blue fluorescent protein: A first-principles study
X Lopez, MAL Marques, A Castro, A Rubio
Journal of the American Chemical Society 127 (35), 12329-12337, 2005
822005
Controlling the dynamics of many-electron systems from first principles: a combination of optimal control and time-dependent density-functional theory
A Castro, J Werschnik, EKU Gross
Physical review letters 109 (15), 153603, 2012
802012
Can optical spectroscopy directly elucidate the ground state of
A Castro, MAL Marques, JA Alonso, GF Bertsch, K Yabana, A Rubio
The Journal of chemical physics 116 (5), 1930-1933, 2002
692002
Optical properties of nanostructures from time-dependent density functional theory
A Castro, MAL Marques, JA Alonso, A Rubio
Journal of Computational and Theoretical Nanoscience 1 (3), 231-255, 2004
652004
Simulating Pump–Probe Photoelectron and Absorption Spectroscopy on the Attosecond Timescale with Time‐Dependent Density Functional Theory
U De Giovannini, G Brunetto, A Castro, J Walkenhorst, A Rubio
ChemPhysChem 14 (7), 1363-1376, 2013
612013
Optical and magnetic properties of boron fullerenes
S Botti, A Castro, NN Lathiotakis, X Andrade, MAL Marques
Physical Chemistry Chemical Physics 11 (22), 4523-4527, 2009
532009
Solution of Poisson's equation for finite systems using plane-wave methods
A Castro, A Rubio, MJ Stott
Canadian Journal of Physics 81 (10), 1151-1164, 2003
522003
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Articles 1–20