TRR 142 - Project Area B

Project Period: 2014-04-01
Externally Funded
Acronym
TRR 142 - B
Funding Organisation
DFG

52 Publications

2017 | Journal Article | LibreCat-ID: 7481
Zn–VI quasiparticle gaps and optical spectra from many-body calculations
A. Riefer, N. Weber, J. Mund, D.R. Yakovlev, M. Bayer, A. Schindlmayr, C. Meier, W.G. Schmidt, Journal of Physics: Condensed Matter 29 (2017).
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2017 | Journal Article | LibreCat-ID: 3434
Impact of carbon-ion implantation on the nonlinear optical susceptibility of LiNbO3
K.J. Spychala, G. Berth, A. Widhalm, M. Rüsing, L. Wang, S. Sanna, A. Zrenner, OPTICS EXPRESS (2017) 21444--21453.
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2015 | Journal Article | LibreCat-ID: 6522
Electric field effect on optical harmonic generation at the exciton resonances in GaAs
D. Brunne, M. Lafrentz, V.V. Pavlov, R.V. Pisarev, A.V. Rodina, D.R. Yakovlev, M. Bayer, Physical Review B 92 (2015).
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2018 | Journal Article | LibreCat-ID: 10019
Identifying On-Surface Site-Selective Chemical Conversions by Theory-Aided NEXAFS Spectroscopy: The Case of Free-Base Corroles on Ag(111)
H. Aldahhak, M. Paszkiewicz, E. Rauls, F. Allegretti, S. Tebi, A.C. Papageorgiou, Y.-Q. Zhang, L. Zhang, T. Lin, T. Paintner, R. Koch, W.G. Schmidt, J.V. Barth, W. Schöfberger, S. Müllegger, F. Klappenberger, U. Gerstmann, Chemistry - A European Journal (2018) 6787–6797.
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2015 | Journal Article | LibreCat-ID: 10033
Modeling atomic force microscopy at LiNbO 3 surfaces from first-principles
S. Sanna, C. Dues, W.G. Schmidt, Computational Materials Science (2015) 145–150.
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2015 | Journal Article | LibreCat-ID: 13506
Polaronic deformation at theFe2+/3+impurity site inFe:LiNbO3crystals
A. Sanson, A. Zaltron, N. Argiolas, C. Sada, M. Bazzan, W.G. Schmidt, S. Sanna, Physical Review B 91 (2015).
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2019 | Journal Article | LibreCat-ID: 10014
Quasiparticle and excitonic effects in the optical response of KNbO3
F. Schmidt, A. Riefer, W.G. Schmidt, A. Schindlmayr, M. Imlau, F. Dobener, N. Mengel, S. Chatterjee, S. Sanna, Physical Review Materials (2019).
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2016 | Journal Article | LibreCat-ID: 10026
Vibrational properties ofLiNb1−xTaxO3mixed crystals
M. Rüsing, S. Sanna, S. Neufeld, G. Berth, W.G. Schmidt, A. Zrenner, H. Yu, Y. Wang, H. Zhang, Physical Review B (2016).
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2017 | Journal Article | LibreCat-ID: 10021
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 (2017).
LibreCat | DOI
 
2015 | Journal Article | LibreCat-ID: 13486
LiTaO3 phonon dispersion and ferroelectric transition calculated from first principles
M. Friedrich, A. Schindlmayr, W.G. Schmidt, S. Sanna, Physica Status Solidi (B) 253 (2015) 683–689.
LibreCat | DOI
 
2015 | Journal Article | LibreCat-ID: 4332
Raman scattering efficiency inLiTaO3andLiNbO3crystals
S. Sanna, S. Neufeld, M. Rüsing, G. Berth, A. Zrenner, W.G. Schmidt, Physical Review B 91 (2015).
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2018 | Journal Article | LibreCat-ID: 4370
Signatures of transient Wannier-Stark localization in bulk gallium arsenide
C. Schmidt, J. Bühler, A.-C. Heinrich, J. Allerbeck, R. Podzimski, D. Berghoff, T. Meier, W.G. Schmidt, C. Reichl, W. Wegscheider, D. Brida, A. Leitenstorfer, Nature Communications 9 (2018).
LibreCat | DOI
 
2015 | Journal Article | LibreCat-ID: 10027
GaNm-plane: Atomic structure, surface bands, and optical response
M. Landmann, E. Rauls, W.G. Schmidt, M.D. Neumann, E. Speiser, N. Esser, Physical Review B (2015).
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2015 | Journal Article | LibreCat-ID: 13507
GaNm-plane: Atomic structure, surface bands, and optical response
M. Landmann, E. Rauls, W.G. Schmidt, M.D. Neumann, E. Speiser, N. Esser, Physical Review B 91 (2015).
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2014 | Journal Article | LibreCat-ID: 13514
IntrinsicLiNbO3point defects from hybrid density functional calculations
Y. Li, W.G. Schmidt, S. Sanna, Physical Review B 89 (2014).
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2017 | Journal Article | LibreCat-ID: 10022
Zn–VI quasiparticle gaps and optical spectra from many-body calculations
A. Riefer, N. Weber, J. Mund, D.R. Yakovlev, M. Bayer, A. Schindlmayr, C. Meier, W.G. Schmidt, Journal of Physics: Condensed Matter (2017).
LibreCat | DOI
 
2019 | Journal Article | LibreCat-ID: 10015
Water Splitting Reaction at Polar Lithium Niobate Surfaces
C. Dues, W.G. Schmidt, S. Sanna, ACS Omega (2019) 3850–3859.
LibreCat | DOI
 
2015 | Journal Article | LibreCat-ID: 13817
Phonon dispersion and zero-point renormalization of LiNbO3from density-functional perturbation theory
M. Friedrich, A. Riefer, S. Sanna, W.G. Schmidt, A. Schindlmayr, Journal of Physics: Condensed Matter 27 (2015).
LibreCat | DOI
 
2016 | Journal Article | LibreCat-ID: 4240
Joint Raman spectroscopy and HRXRD investigation of cubic gallium nitride layers grown on 3C-SiC
M. Rüsing, T. Wecker, G. Berth, D.J. As, A. Zrenner, Physica Status Solidi (B) 253 (2016) 778–782.
LibreCat | DOI
 
2016 | Journal Article | LibreCat-ID: 7484
Fabrication of fully undercut ZnO-based photonic crystal membranes with 3D optical confinement
S.P. Hoffmann, M. Albert, C. Meier, Superlattices and Microstructures 97 (2016) 397–408.
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2018 | Journal Article | LibreCat-ID: 4769
Imaging of 180∘ ferroelectric domain walls in uniaxial ferroelectrics by confocal Raman spectroscopy: Unraveling the contrast mechanism
M. Rüsing, S. Neufeld, J. Brockmeier, C. Eigner, P. Mackwitz, K. Spychala, C. Silberhorn, W.G. Schmidt, G. Berth, A. Zrenner, S. Sanna, Physical Review Materials 2 (2018).
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2015 | Journal Article | LibreCat-ID: 10031
Defect complexes in congruentLiNbO3and their optical signatures
Y. Li, W.G. Schmidt, S. Sanna, Physical Review B (2015).
LibreCat | DOI
 
2015 | Journal Article | LibreCat-ID: 13504
Modeling atomic force microscopy at LiNbO 3 surfaces from first-principles
S. Sanna, C. Dues, W.G. Schmidt, Computational Materials Science 103 (2015) 145–150.
LibreCat | DOI
 
2018 | Journal Article | LibreCat-ID: 10017
Imaging of 180∘ ferroelectric domain walls in uniaxial ferroelectrics by confocal Raman spectroscopy: Unraveling the contrast mechanism
M. Rüsing, S. Neufeld, J. Brockmeier, C. Eigner, P. Mackwitz, K. Spychala, C. Silberhorn, W.G. Schmidt, G. Berth, A. Zrenner, S. Sanna, Physical Review Materials (2018).
LibreCat | DOI
 
2016 | Journal Article | LibreCat-ID: 10024
LiNbO3electronic 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 (2016).
LibreCat | DOI
 
2015 | Journal Article | LibreCat-ID: 10029
Liquid Crystal (8CB) Molecular Adsorption on Lithium Niobate Z-Cut Surfaces
C. Braun, S. Sanna, W.G. Schmidt, The Journal of Physical Chemistry C (2015) 9342–9346.
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2014 | Journal Article | LibreCat-ID: 10036
Modeling LiNbO3 Surfaces at Ambient Conditions
R. Hölscher, W.G. Schmidt, S. Sanna, The Journal of Physical Chemistry C (2014) 10213–10220.
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2018 | Journal Article | LibreCat-ID: 13410 LibreCat | DOI
 
2016 | Journal Article | LibreCat-ID: 4239
Identification of ferroelectric domain structure sensitive phonon modes in potassium titanyl phosphate: A fundamental study
M. Rüsing, C. Eigner, P. Mackwitz, G. Berth, C. Silberhorn, A. Zrenner, Journal of Applied Physics 119 (2016).
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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).
LibreCat | DOI
 
2016 | Journal Article | LibreCat-ID: 6533
Thermochromic modulation of surface plasmon polaritons in vanadium dioxide nanocomposites
T. Jostmeier, M. Mangold, J. Zimmer, H. Karl, H.J. Krenner, C. Ruppert, M. Betz, Optics Express 24 (2016).
LibreCat | DOI
 
2019 | Journal Article | LibreCat-ID: 9897
Strong nonlinear optical response from ZnO by coupled and lattice-matched nanoantennas
M. Protte, N. Weber, C. Golla, T. Zentgraf, C. Meier, Journal of Applied Physics (2019).
LibreCat | DOI
 
2018 | Journal Article | LibreCat-ID: 10013
Beyond the molecular movie: Dynamics of bands and bonds during a photoinduced phase transition
C.W. Nicholson, A. Lücke, W.G. Schmidt, M. Puppin, L. Rettig, R. Ernstorfer, M. Wolf, Science (2018) 821–825.
LibreCat | DOI
 
 
2015 | Journal Article | LibreCat-ID: 10032
Raman scattering efficiency inLiTaO3andLiNbO3crystals
S. Sanna, S. Neufeld, M. Rüsing, G. Berth, A. Zrenner, W.G. Schmidt, Physical Review B (2015).
LibreCat | DOI
 
2017 | Journal Article | LibreCat-ID: 13428
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) 1–13.
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2017 | Journal Article | LibreCat-ID: 13416
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 | DOI
 
2019 | Journal Article | LibreCat-ID: 13365
Potassium titanyl phosphate (KTP) quasiparticle energies and optical response
S. Neufeld, A. Bocchini, U. Gerstmann, A. Schindlmayr, W.G. Schmidt, Journal of Physics: Materials (2019).
LibreCat | DOI
 
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 | DOI
 
2018 | Journal Article | LibreCat-ID: 10018
Signatures of transient Wannier-Stark localization in bulk gallium arsenide
C. Schmidt, J. Bühler, A.-C. Heinrich, J. Allerbeck, R. Podzimski, D. Berghoff, T. Meier, W.G. Schmidt, C. Reichl, W. Wegscheider, D. Brida, A. Leitenstorfer, Nature Communications 9 (2018) 2890.
LibreCat | DOI
 
2016 | Journal Article | LibreCat-ID: 4186
Vibrational properties of LiNb1−xTaxO3 mixed crystals
M. Rüsing, S. Sanna, S. Neufeld, G. Berth, W.G. Schmidt, A. Zrenner, H. Yu, Y. Wang, H. Zhang, Physical Review B 93 (2016).
LibreCat | DOI
 
2016 | Journal Article | LibreCat-ID: 4237
Periodic domain inversion in x-cut single-crystal lithium niobate thin film
P. Mackwitz, M. Rüsing, G. Berth, A. Widhalm, K. Müller, A. Zrenner, Applied Physics Letters 108 (2016).
LibreCat | DOI
 
2018 | Journal Article | LibreCat-ID: 1430
Tailored UV Emission by Nonlinear IR Excitation from ZnO Photonic Crystal Nanocavities
S.P. Hoffmann, M. Albert, N. Weber, D. Sievers, J. Förstner, T. Zentgraf, C. Meier, ACS Photonics 5 (2018) 1933–1942.
LibreCat | Files available | DOI
 
2015 | Conference Paper | LibreCat-ID: 6529
Novel mechanisms of optical harmonic generation on excitons in semiconductors
D.R. Yakovlev, W. Warkentin, D. Brunne, J. Mund, V.V. Pavlov, A.V. Rodina, R.V. Pisarev, M. Bayer, in: M. Bertolotti, J.W. Haus, A.M. Zheltikov (Eds.), Nonlinear Optics and Applications IX, SPIE, 2015.
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2019 | Journal Article | LibreCat-ID: 9698
Zinc oxide based dielectric nanoantennas for efficient nonlinear frequency conversion
C. Golla, N. Weber, C. Meier, Journal of Applied Physics (2019).
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2018 | Journal Article | LibreCat-ID: 10016
Unraveling the Oxidation and Spin State of Mn–Corrole through X-ray Spectroscopy and Quantum Chemical Analysis
M. Paszkiewicz, T. Biktagirov, H. Aldahhak, F. Allegretti, E. Rauls, W. Schöfberger, W.G. Schmidt, J.V. Barth, U. Gerstmann, F. Klappenberger, The Journal of Physical Chemistry Letters (2018) 6412–6420.
LibreCat | DOI
 
2014 | Journal Article | LibreCat-ID: 10035
Modeling intrinsic defects in LiNbO3 within the Slater-Janak transition state model
Y. Li, S. Sanna, W.G. Schmidt, The Journal of Chemical Physics (2014).
LibreCat | DOI
 
2019 | Journal Article | LibreCat-ID: 12930
High-precision determination of silicon nanocrystals: optical spectroscopy versus electron microscopy
R. Köthemann, N. Weber, J.K.N. Lindner, C. Meier, Semiconductor Science and Technology 34 (2019).
LibreCat | DOI
 
2014 | Journal Article | LibreCat-ID: 13515
Temperature dependent LiNbO3(0001): Surface reconstruction and surface charge
S. Sanna, R. Hölscher, W.G. Schmidt, Applied Surface Science (2014) 70–78.
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2017 | Journal Article | LibreCat-ID: 13414 LibreCat | DOI
 
2019 | Journal Article | LibreCat-ID: 14544
Spatially asymmetric transients of propagating exciton-polariton modes in a planar CdZnTe/CdMgTe guiding structure
J. Vondran, F. Spitzer, M. Bayer, I.A. Akimov, A. Trautmann, M. Reichelt, C. Meier, N. Weber, T. Meier, R. André, H. Mariette, Physical Review B (2019).
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