Publikationen

Publikationen

Zeitschriftenartikel (36)

2017
Zeitschriftenartikel
Self-consistent DFT + U method for real-space time-dependent density functional theory calculations
N. Tancogne-Dejean, M. J. T. Oliveira, A. Rubio
Physical Review B 96 (24), 245133 (2017)
MPG.PuRe
DOI
publisher-version
Zeitschriftenartikel
Exchange-correlation approximations for reduced-density-matrix-functional theory at finite temperature: Capturing magnetic phase transitions in the homogeneous electron gas
T. Baldsiefen, A. Cangi, F. G. Eich, E. K. U. Gross
Physical Review A 96 (6), 062508 (2017)
MPG.PuRe
DOI
publisher-version
Zeitschriftenartikel
Electronic band gaps of confined linear carbon chains ranging from polyyne to carbyne
L. Shi, P. Rohringer, M. Wanko, A. Rubio, S. Waßerroth, S. Reich, S. Cambré, W. Wenseleers, P. Ayala, T. Pichler
Physical Review Materials 1 (7), 075601 (2017)
MPG.PuRe
DOI
publisher-version
Zeitschriftenartikel
Exact functionals for correlated electron-photon systems
T. Dimitrov, J. Flick, M. Ruggenthaler, A. Rubio
New Journal of Physics 19, 113036 (2017)
MPG.PuRe
DOI
publisher-version
Zeitschriftenartikel
Time-dependent Landauer-Büttiker approach to charge pumping in ac-driven graphene nanoribbons
M. Ridley, R. Tuovinen
Physical Review B 96 (19), 195429 (2017)
MPG.PuRe
DOI
publisher-version
Zeitschriftenartikel
Towards efficient data exchange and sharing for big-data driven materials science: metadata and data formats
L. M. Ghiringhelli, C. Carbogno, S. Levchenko, F. Mohamed, G. Huhs, M. Lüders, M. J. T. Oliveira, M. Scheffler
npj Computational Materials 3, UNSP 46 (2017)
MPG.PuRe
DOI
publisher-version
Zeitschriftenartikel
Ellipticity dependence of high-harmonic generation in solids originating from coupled intraband and interband dynamics
N. Tancogne-Dejean, O. D. Mücke, F. X. Kärtner, A. Rubio
Nature Communications 8, 745 (2017)
MPG.PuRe
DOI
publisher-version
Zeitschriftenartikel
Modeling of laser-pulse induced water decomposition on two-dimensional materials by simulations based on time-dependent density functional theory
Y. Miyamoto, H. Zhang, X. Cheng, A. Rubio
Physical Review B 96 (11), 115451 (2017)
MPG.PuRe
DOI
Full
publisher-version
supplementary-material
Zeitschriftenartikel
[Viewpoint:] Inducing Multiple Reactions with a Single Photon
M. Ruggenthaler
Physics 10, 105 (2017)
MPG.PuRe
DOI
publisher-version
Zeitschriftenartikel
Review of the theoretical description of time-resolved angle-resolved photoemission spectroscopy in electron-phonon mediated superconductors
A. F. Kemper, M. A. Sentef, B. Moritz, T. P. Devereaux, J. K. Freericks
Annalen der Physik 529 (9), 1600235 (2017)
MPG.PuRe
DOI
pre-print
publisher-version
Zeitschriftenartikel
Square selenene and tellurene: novel group VI elemental 2D materials with nontrivial topological properties
L. D. Xian, A. P. Paz, E. Bianco, P. M. Ajayan, A. Rubio
2D Materials 4 (4), 041003 (2017)
MPG.PuRe
DOI
pre-print
publisher-version
Zeitschriftenartikel
U(1)×SU(2) gauge invariance made simple for density functional approximations
S. Pittalis, G. Vignale, F. G. Eich
Physical Review B 96 (3), 035141 (2017)
MPG.PuRe
DOI
publisher-version
Zeitschriftenartikel
Momentum-Resolved View of Electron-Phonon Coupling in Multilayer WSe2
L. Waldecker, R. Bertoni, H. Hübener, T. Brumme, T. Vasileiadis, D. Zahn, A. Rubio, R. Ernstorfer
Physical Review Letters 119 (3), 036803 (2017)
MPG.PuRe
DOI
publisher-version
Zeitschriftenartikel
Anomalous anisotropic exciton temperature dependence in rutile TiO2
E. Baldini, A. Dominguez, L. Chiodo, E. Sheveleva, M. Yazdi-Rizi, C. Bernhard, A. Rubio, M. Chergui
Physical Review B 96 (4), 041204 (2017)
MPG.PuRe
DOI
publisher-version
supplementary-material
Zeitschriftenartikel
Effective mass of quasiparticles from thermodynamics
F. G. Eich, M. Holzmann, and G. Vignale
Physical Review B 96 (3), 035132 (2017)
MPG.PuRe
DOI
publisher-version
Zeitschriftenartikel
Controlling heat and particle currents in nanodevices by quantum observation
R. Biele, C. A. Rodríguez-Rosario, T. Frauenheim, A. Rubio
npj Quantum Materials 2, 38 (2017)
MPG.PuRe
DOI
pre-print
publisher-version
Zeitschriftenartikel
TDDFT-Based Study on the Proton-DNA Collision
R. Seraide, M. A. Bernal, G. Brunetto, U. de Giovannini, A. Rubio
The Journal of Physical Chemistry B 121 (30), 7276–7283 (2017)
MPG.PuRe
DOI
pre-print
Zeitschriftenartikel
Ab initio Modelling of Plasmons in Metal-semiconductor Bilayer Transition-metal Dichalcogenide Heterostructures
H. S. Sen, L. Xian, F. da Jornada, S. G. Louie, A. Rubio
Israel Journal of Chemistry 57 (6), 540–546 (2017)
MPG.PuRe
DOI
Zeitschriftenartikel
Nonlocally sensing the magnetic states of nanoscale antiferromagnets with an atomic spin sensor
S. Yan, L. Malavolti, J. A. J. Burgess, A. Droghetti, A. Rubio, S. Loth
Science Advances 3 (5), e1603137 (2017)
MPG.PuRe
DOI
publisher-version
Zeitschriftenartikel
Light-enhanced electron-phonon coupling from nonlinear electron-phonon coupling
M. A. Sentef
Physical Review B 95 (20), 205111 (2017)
MPG.PuRe
DOI
publisher-version
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