Miguel Alexandre Lopes Marques
Miguel Alexandre Lopes Marques
Verified email at physik.uni-halle.de - Homepage
TitleCited byYear
Time-dependent density functional theory
MAL Marques, EKU Gross
Annu. Rev. Phys. Chem. 55, 427-455, 2004
1119*2004
A primer in density functional theory
C Fiolhais, F Nogueira, MAL Marques
Springer, 2003
6872003
Time-dependent density functional theory
MAL Marques, CA Ullrich, F Nogueira, A Rubio, K Burke, EKU Gross
Springer, 2006
6802006
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
6512003
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
6402006
Fundamentals of time-dependent density functional theory
MAL Marques, NT Maitra, FMS Nogueira, EKU Gross, A Rubio
Springer, 2012
4432012
Propagators for the time-dependent Kohn–Sham equations
A Castro, MAL Marques, A Rubio
The Journal of chemical physics 121 (8), 3425-3433, 2004
4342004
Libxc: A library of exchange and correlation functionals for density functional theory
MAL Marques, MJT Oliveira, T Burnus
Computer physics communications 183 (10), 2272-2281, 2012
3272012
Crystal structure of cold compressed graphite
M Amsler, JA Flores-Livas, L Lehtovaara, F Balima, SA Ghasemi, ...
Physical review letters 108 (6), 065501, 2012
2462012
Density-based mixing parameter for hybrid functionals
MAL Marques, J Vidal, MJT Oliveira, L Reining, S Botti
Physical Review B 83 (3), 035119, 2011
2432011
Time-dependent density functional theory
MAL Marques, EKU Gross
A Primer in Density Functional Theory, 144-184, 2003
231*2003
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
2212015
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
Ab initio theory of superconductivity. I. Density functional formalism and approximate functionals
M Lüders, MAL Marques, NN Lathiotakis, A Floris, G Profeta, L Fast, ...
Physical Review B 72 (2), 024545, 2005
2112005
TDDFT in massively parallel computer architectures: the octopus project
X Andrade, J Alberdi-Rodriguez, DA Strubbe, MJT Oliveira, F Nogueira, ...
194*2012
Direct observation of the mechanical properties of single-walled carbon nanotubes and their junctions at the atomic level
HE Troiani, M Miki-Yoshida, GA Camacho-Bragado, MAL Marques, ...
Nano letters 3 (6), 751-755, 2003
1662003
Ab initio theory of superconductivity. II. Application to elemental metals
MAL Marques, M Lüders, NN Lathiotakis, G Profeta, A Floris, L Fast, ...
Physical Review B 72 (2), 024546, 2005
1642005
Benchmarking the starting points of the GW approximation for molecules
F Bruneval, MAL Marques
Journal of Chemical Theory and Computation, 2012
1632012
Superconducting Properties of MgB_ {2} from First Principles
A Floris, G Profeta, NN Lathiotakis, M Lüders, MAL Marques, C Franchini, ...
Physical review letters 94 (3), 037004, 2005
1572005
Superconductivity in lithium, potassium, and aluminum under extreme pressure: A first-principles study
G Profeta, C Franchini, NN Lathiotakis, A Floris, A Sanna, MAL Marques, ...
Physical review letters 96 (4), 047003, 2006
1472006
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