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882 Publications


2017 | Journal Article | LibreCat-ID: 13360
Ultrafast Electronic Energy Transfer in an Orthogonal Molecular Dyad
C. Wiebeler, F. Plasser, G.J. Hedley, A. Ruseckas, I.D.W. Samuel, S. Schumacher, The Journal of Physical Chemistry Letters (2017) 1086–1092.
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2017 | Journal Article | LibreCat-ID: 13361
Controlling the optical spin Hall effect with light
O. Lafont, S.M.H. Luk, P. Lewandowski, N.H. Kwong, P.T. Leung, E. Galopin, A. Lemaitre, J. Tignon, S. Schumacher, E. Baudin, R. Binder, Applied Physics Letters (2017).
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2017 | Journal Article | LibreCat-ID: 13364
Optical switching of polariton density patterns in a semiconductor microcavity
N.H. Kwong, C.Y. Tsang, S.M.H. Luk, Y.C. Tse, C.K.P. Chan, P. Lewandowski, P.T. Leung, S. Schumacher, R. Binder, Physica Scripta (2017).
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2017 | Journal Article | LibreCat-ID: 13412
New pyridinium based ionic dyes for the hydrogen evolution reaction
D.D. Konieczna, H. Biller, M. Witte, W.G. Schmidt, A. Neuba, R. Wilhelm, Tetrahedron (2017) 142–149.
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2017 | Journal Article | LibreCat-ID: 13414
Solving the Bethe-Salpeter equation for the second-harmonic generation in Zn chalcogenides
A. Riefer, W.G. Schmidt, Physical Review B 96 (2017).
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2017 | Journal Article | LibreCat-ID: 13415
Si(775)-Au atomic chains: Geometry, optical properties, and spin order
C. Braun, C. Hogan, S. Chandola, N. Esser, S. Sanna, W.G. Schmidt, Physical Review Materials 1 (2017).
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2017 | Journal Article | LibreCat-ID: 13416 | OA
Polaron optical absorption in congruent lithium niobate from time-dependent density-functional theory
M. Friedrich, W.G. Schmidt, A. Schindlmayr, S. Sanna, Physical Review Materials 1 (2017).
LibreCat | Files available | DOI | WoS
 

2017 | Journal Article | LibreCat-ID: 13417
Efficient PAW-based bond strength analysis for understanding the In/Si(111)(8 × 2) - (4 × 1) phase transition
A. Lücke, U. Gerstmann, T.D. Kühne, W.G. Schmidt, Journal of Computational Chemistry (2017) 2276–2282.
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2017 | Journal Article | LibreCat-ID: 13418
LiNbO3 surfaces from a microscopic perspective
S. Sanna, W.G. Schmidt, Journal of Physics: Condensed Matter (2017).
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2017 | Journal Article | LibreCat-ID: 13419
Optically excited structural transition in atomic wires on surfaces at the quantum limit
T. Frigge, B. Hafke, T. Witte, B. Krenzer, C. Streubühr, A. Samad Syed, V. Mikšić Trontl, I. Avigo, P. Zhou, M. Ligges, D. von der Linde, U. Bovensiepen, M. Horn-von Hoegen, S. Wippermann, A. Lücke, S. Sanna, U. Gerstmann, W.G. Schmidt, Nature 544 (2017) 207–211.
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2017 | Journal Article | LibreCat-ID: 13420
Current density analysis of electron transport through molecular wires in open quantum systems
D. Nozaki, W.G. Schmidt, Journal of Computational Chemistry 38 (2017) 1685–1692.
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2017 | Journal Article | LibreCat-ID: 13421
Understanding band alignments in semiconductor heterostructures: Composition dependence and type-I–type-II transition of natural band offsets in nonpolar zinc-blendeAlxGa1−xN/AlyGa1−yNcomposites
M. Landmann, E. Rauls, W.G. Schmidt, Physical Review B 95 (2017).
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2017 | Journal Article | LibreCat-ID: 13422
[Cu6(NGuaS)6]2+ and its oxidized and reduced derivatives: Confining electrons on a torus
M. Witte, M. Rohrmüller, U. Gerstmann, G. Henkel, W.G. Schmidt, S. Herres-Pawlis, Journal of Computational Chemistry (2017) 1752–1761.
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2017 | Journal Article | LibreCat-ID: 13423
On-Surface Site-Selective Cyclization of Corrole Radicals
S. Tebi, M. Paszkiewicz, H. Aldahhak, F. Allegretti, S. Gonglach, M. Haas, M. Waser, P.S. Deimel, P.C. Aguilar, Y.-Q. Zhang, A.C. Papageorgiou, D.A. Duncan, J.V. Barth, W.G. Schmidt, R. Koch, U. Gerstmann, E. Rauls, F. Klappenberger, W. Schöfberger, S. Müllegger, ACS Nano (2017) 3383–3391.
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2017 | Journal Article | LibreCat-ID: 13424
X-ray Spectroscopy of Thin Film Free-Base Corroles: A Combined Theoretical and Experimental Characterization
H. Aldahhak, M. Paszkiewicz, F. Allegretti, D.A. Duncan, S. Tebi, P.S. Deimel, P. Casado Aguilar, Y.-Q. Zhang, A.C. Papageorgiou, R. Koch, J.V. Barth, W.G. Schmidt, S. Müllegger, W. Schöfberger, F. Klappenberger, E. Rauls, U. Gerstmann, The Journal of Physical Chemistry C 121 (2017) 2192–2200.
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2017 | Journal Article | LibreCat-ID: 13425
Electron paramagnetic resonance calculations for hydrogenated Si surfaces
M. Rohrmüller, W.G. Schmidt, U. Gerstmann, Physical Review B 95 (2017).
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2017 | Journal Article | LibreCat-ID: 13426
Tuning the conductivity along atomic chains by selective chemisorption
F. Edler, I. Miccoli, J.P. Stöckmann, H. Pfnür, C. Braun, S. Neufeld, S. Sanna, W.G. Schmidt, C. Tegenkamp, Physical Review B 95 (2017).
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2017 | Journal Article | LibreCat-ID: 13427
Molecular Orbital Rule for Quantum Interference in Weakly Coupled Dimers: Low-Energy Giant Conductivity Switching Induced by Orbital Level Crossing
D. Nozaki, A. Lücke, W.G. Schmidt, The Journal of Physical Chemistry Letters (2017) 727–732.
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2017 | Journal Article | LibreCat-ID: 10021 | OA
Optical properties of titanium-doped lithium niobate from time-dependent density-functional theory
M. Friedrich, W.G. Schmidt, A. Schindlmayr, S. Sanna, Physical Review Materials 1 (2017).
LibreCat | Files available | DOI | WoS
 

2017 | Journal Article | LibreCat-ID: 10023 | OA
Consistent atomic geometries and electronic structure of five phases of potassium niobate from density-functional theory
F. Schmidt, M. Landmann, E. Rauls, N. Argiolas, S. Sanna, W.G. Schmidt, A. Schindlmayr, Advances in Materials Science and Engineering 2017 (2017).
LibreCat | Files available | DOI | WoS
 

2017 | Journal Article | LibreCat-ID: 13803
Advanced capabilities for materials modelling with Quantum ESPRESSO
P. Giannozzi, O. Andreussi, T. Brumme, O. Bunau, M. Buongiorno Nardelli, M. Calandra, R. Car, C. Cavazzoni, D. Ceresoli, M. Cococcioni, N. Colonna, I. Carnimeo, A. Dal Corso, S. de Gironcoli, P. Delugas, R.A. DiStasio, A. Ferretti, A. Floris, G. Fratesi, G. Fugallo, R. Gebauer, U. Gerstmann, F. Giustino, T. Gorni, J. Jia, M. Kawamura, H.-Y. Ko, A. Kokalj, E. Küçükbenli, M. Lazzeri, M. Marsili, N. Marzari, F. Mauri, N.L. Nguyen, H.-V. Nguyen, A. Otero-de-la-Roza, L. Paulatto, S. Poncé, D. Rocca, R. Sabatini, B. Santra, M. Schlipf, A.P. Seitsonen, A. Smogunov, I. Timrov, T. Thonhauser, P. Umari, N. Vast, X. Wu, S. Baroni, Journal of Physics: Condensed Matter 29 (2017).
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2017 | Journal Article | LibreCat-ID: 13359
Creation and Manipulation of Stable Dark Solitons and Vortices in Microcavity Polariton Condensates
X. Ma, O.A. Egorov, S. Schumacher, Physical Review Letters 118 (2017).
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2017 | Journal Article | LibreCat-ID: 13356
Vortex-vortex control in exciton-polariton condensates
X. Ma, S. Schumacher, Physical Review B 95 (2017).
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2017 | Journal Article | LibreCat-ID: 13358
Enhanced columnar mesophase range through distortions in arene cores
J. Vollbrecht, C. Wiebeler, S. Schumacher, H. Bock, H.-S. Kitzerow, Molecular Crystals and Liquid Crystals (2017) 66–73.
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2017 | Journal Article | LibreCat-ID: 40389
Orbital angular momentum modes of high-gain parametric down-conversion
L. Beltran, G. Frascella, A.M. Perez, R. Fickler, P. Sharapova, M. Manceau, O.V. Tikhonova, R.W. Boyd, G. Leuchs, M.V. Chekhova, Journal of Optics 19 (2017).
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2017 | Journal Article | LibreCat-ID: 40391
Coherent control of atomic qubits by non-classical light
S.N. Balybin, P. Sharapova, O.V. Tikhonova, The European Physical Journal D 71 (2017).
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2017 | Journal Article | LibreCat-ID: 13289
Bloch oscillations and resonant radiation of light propagating in arrays of nonlinear fibers with high-order dispersion
A. Yulin, R. Driben, T. Meier, Physical Review A 96 (2017).
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2017 | Journal Article | LibreCat-ID: 13332
Anisotropic excitons and their contributions to shift current transients in bulk GaAs
R. Podzimski, H.T. Duc, T. Meier, Physical Review B 96 (2017).
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2017 | Journal Article | LibreCat-ID: 7480
Time-resolved photon echoes from donor-bound excitons in ZnO epitaxial layers
S.V. Poltavtsev, A.N. Kosarev, I.A. Akimov, D.R. Yakovlev, S. Sadofev, J. Puls, S.P. Hoffmann, M. Albert, C. Meier, T. Meier, M. Bayer, Physical Review B 96 (2017).
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2017 | Journal Article | LibreCat-ID: 13906
Toolbox for the design of LiNbO3-based passive and active integrated quantum circuits
P. Sharapova, K.H. Luo, H. Herrmann, M. Reichelt, T. Meier, C. Silberhorn, New Journal of Physics 19 (2017).
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2017 | Journal Article | LibreCat-ID: 13905
Modified two-photon interference achieved by the manipulation of entanglement
P. Sharapova, K.H. Luo, H. Herrmann, M. Reichelt, C. Silberhorn, T. Meier, Physical Review A 96 (2017) 043857.
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2017 | Journal Article | LibreCat-ID: 26061
Toolbox for the design of LiNbO3-based passive and active integrated quantum circuits
P. Sharapova, K.H. Luo, H. Herrmann, M. Reichelt, T. Meier, C. Silberhorn, New Journal of Physics 19 (2017).
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2017 | Journal Article | LibreCat-ID: 43885 | OA
Generation and active manipulation of qubits in LiNbO3-based integrated circuits
T. Meier, P.R. Sharapova, K.H. Luo, H. Herrmann, M. Reichelt, C. Silberhorn, ArXiv Preprint ArXiv:1704.03769 (2017).
LibreCat | Download (ext.)
 

2017 | Journal Article | LibreCat-ID: 26306
Two-particle four-point correlations in dynamically disordered tight-binding networks
A. Perez-Leija, R. de J. Leon-Montiel, J. Sperling, H. Moya-Cessa, A. Szameit, K. Busch, Journal of Physics B: Atomic, Molecular and Optical Physics (2017).
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2017 | Journal Article | LibreCat-ID: 13909
High-Resolution Two-Dimensional Optical Spectroscopy of Electron Spins
M. Salewski, S.V. Poltavtsev, I.A. Yugova, G. Karczewski, M. Wiater, T. Wojtowicz, D.R. Yakovlev, I.A. Akimov, T. Meier, M. Bayer, Physical Review X 7 (2017).
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2017 | Conference Paper | LibreCat-ID: 13903
Towards integrated superconducting detectors on lithium niobate waveguides
J.P. Höpker, M. Bartnick, E. Meyer-Scott, F. Thiele, T. Meier, T. Bartley, S. Krapick, N.M. Montaut, M. Santandrea, H. Herrmann, S. Lengeling, R. Ricken, V. Quiring, A.E. Lita, V.B. Verma, T. Gerrits, S.W. Nam, C. Silberhorn, in: M. Agio, K. Srinivasan, C. Soci (Eds.), Quantum Photonic Devices, SPIE, 2017, p. 1035809.
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2017 | Conference Paper | LibreCat-ID: 13334
A microscopic approach to ultrafast near band gap photocurrents in bulk semiconductors
R. Podzimski, H.T. Duc, T. Meier, in: M. Betz, A.Y. Elezzabi (Eds.), Ultrafast Phenomena and Nanophotonics XXI, SPIE, 2017.
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2017 | Journal Article | LibreCat-ID: 13908
Damping of Rabi oscillations in intensity-dependent photon echoes from exciton complexes in a CdTe/(Cd,Mg)Te single quantum well
S.V. Poltavtsev, M. Reichelt, I.A. Akimov, G. Karczewski, M. Wiater, T. Wojtowicz, D.R. Yakovlev, T. Meier, M. Bayer, Physical Review B 96 (2017).
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2017 | Journal Article | LibreCat-ID: 13288
Bloch oscillations sustained by nonlinearity
R. Driben, V.V. Konotop, T. Meier, A.V. Yulin, Scientific Reports 7 (2017).
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2016 | Journal Article | LibreCat-ID: 15852
Experimental realization of a polariton beam amplifier
D. Niemietz, J. Schmutzler, P. Lewandowski, K. Winkler, M. Aßmann, S. Schumacher, S. Brodbeck, M. Kamp, C. Schneider, S. Höfling, M. Bayer, Physical Review B (2016).
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2016 | Journal Article | LibreCat-ID: 15853
Dynamics of exciton-polaritons in discrete lattices under incoherent localized pumping
A.V. Yulin, I.Y. Chestnov, X. Ma, S. Schumacher, U. Peschel, O.A. Egorov, Physical Review B (2016).
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2016 | Journal Article | LibreCat-ID: 15854
Polarization dependence of nonlinear wave mixing of spinor polaritons in semiconductor microcavities
P. Lewandowski, O. Lafont, E. Baudin, C.K.P. Chan, P.T. Leung, S.M.H. Luk, E. Galopin, A. Lemaître, J. Bloch, J. Tignon, P. Roussignol, N.H. Kwong, R. Binder, S. Schumacher, Physical Review B (2016).
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2016 | Journal Article | LibreCat-ID: 15855
Patterns and switching dynamics in polaritonic quantum fluids in semiconductor microcavities [Invited]
N.H. Kwong, C.Y. Tsang, M.H. Luk, Y.C. Tse, P. Lewandowski, C.K.P. Chan, P.T. Leung, S. Schumacher, R. Binder, Journal of the Optical Society of America B (2016).
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2016 | Journal Article | LibreCat-ID: 13913
Influence of strong screening effect on the perpendicular- polarized linear excitonic absorption spectra of semiconducting carbon nanotubes
H. Liu, The European Physical Journal B 89 (2016) 230.
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2016 | Journal Article | LibreCat-ID: 13914
Entanglement classification with matrix product states
M. Sanz, I.L. Egusquiza, R. Di Candia, H. Saberi, L. Lamata, E. Solano, Scientific Reports 6 (2016) 30188.
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2016 | Journal Article | LibreCat-ID: 13921
Counterdiabatic driving in spin squeezing and Dicke-state preparation
T. Opatrný, H. Saberi, E. Brion, K. Mølmer, Physical Review A 93 (2016).
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2016 | Journal Article | LibreCat-ID: 13458
Vibration eigenmodes of the Au-(5×2)/Si(111) surface studied by Raman spectroscopy and first-principles calculations
M. Liebhaber, B. Halbig, U. Bass, J. Geurts, S. Neufeld, S. Sanna, W.G. Schmidt, E. Speiser, J. Räthel, S. Chandola, N. Esser, Physical Review B 94 (2016).
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2016 | Journal Article | LibreCat-ID: 13459
Surface induced vibrational modes in the fluorescence spectra of PTCDA adsorbed on the KCl(100) and NaCl(100) surfaces
A. Paulheim, C. Marquardt, M. Sokolowski, M. Hochheim, T. Bredow, H. Aldahhak, E. Rauls, W.G. Schmidt, Physical Chemistry Chemical Physics 18 (2016) 32891–32902.
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2016 | Journal Article | LibreCat-ID: 10024 | OA
LiNbO3 electronic structure: Many-body interactions, spin-orbit coupling, and thermal effects
A. Riefer, M. Friedrich, S. Sanna, U. Gerstmann, A. Schindlmayr, W.G. Schmidt, Physical Review B 93 (2016).
LibreCat | Files available | DOI | WoS
 

2016 | Journal Article | LibreCat-ID: 10025
LiTaO3 phonon dispersion and ferroelectric transition calculated from first principles
M. Friedrich, A. Schindlmayr, W.G. Schmidt, S. Sanna, Physica Status Solidi B 253 (2016) 683–689.
LibreCat | Files available | DOI | WoS
 

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