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983 Publications
2017 | Journal Article | LibreCat-ID: 13416 | 
Friedrich, M., Schmidt, W. G., Schindlmayr, A., & Sanna, S. (2017). Polaron optical absorption in congruent lithium niobate from time-dependent density-functional theory. Physical Review Materials, 1(5), Article 054406. https://doi.org/10.1103/PhysRevMaterials.1.054406
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2017 | Journal Article | LibreCat-ID: 13419
Frigge, T., Hafke, B., Witte, T., Krenzer, B., Streubühr, C., Samad Syed, A., Mikšić Trontl, V., Avigo, I., Zhou, P., Ligges, M., von der Linde, D., Bovensiepen, U., Horn-von Hoegen, M., Wippermann, S., Lücke, A., Sanna, S., Gerstmann, U., & Schmidt, W. G. (2017). Optically excited structural transition in atomic wires on surfaces at the quantum limit. Nature, 544, 207–211. https://doi.org/10.1038/nature21432
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2017 | Journal Article | LibreCat-ID: 13421
Landmann, M., Rauls, E., & Schmidt, W. G. (2017). 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. Physical Review B, 95(15). https://doi.org/10.1103/physrevb.95.155310
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2017 | Journal Article | LibreCat-ID: 13415
Braun, C., Hogan, C., Chandola, S., Esser, N., Sanna, S., & Schmidt, W. G. (2017). Si(775)-Au atomic chains: Geometry, optical properties, and spin order. Physical Review Materials, 1(5). https://doi.org/10.1103/physrevmaterials.1.055002
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| DOI
2017 | Journal Article | LibreCat-ID: 13422
Witte, M., Rohrmüller, M., Gerstmann, U., Henkel, G., Schmidt, W. G., & Herres-Pawlis, S. (2017). [Cu6(NGuaS)6]2+ and its oxidized and reduced derivatives: Confining electrons on a torus. Journal of Computational Chemistry, 1752–1761. https://doi.org/10.1002/jcc.24798
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| DOI
2017 | Journal Article | LibreCat-ID: 13417
Lücke, A., Gerstmann, U., Kühne, T. D., & Schmidt, W. G. (2017). Efficient PAW-based bond strength analysis for understanding the In/Si(111)(8 × 2) - (4 × 1) phase transition. Journal of Computational Chemistry, 2276–2282. https://doi.org/10.1002/jcc.24878
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2017 | Journal Article | LibreCat-ID: 13414
Riefer, A., & Schmidt, W. G. (2017). Solving the Bethe-Salpeter equation for the second-harmonic generation in Zn chalcogenides. Physical Review B, 96(23). https://doi.org/10.1103/physrevb.96.235206
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2017 | Journal Article | LibreCat-ID: 13420
Nozaki, D., & Schmidt, W. G. (2017). Current density analysis of electron transport through molecular wires in open quantum systems. Journal of Computational Chemistry, 38, 1685–1692. https://doi.org/10.1002/jcc.24812
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| DOI
2017 | Journal Article | LibreCat-ID: 13418
Sanna, S., & Schmidt, W. G. (2017). LiNbO3 surfaces from a microscopic perspective. Journal of Physics: Condensed Matter, Article 413001. https://doi.org/10.1088/1361-648x/aa818d
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2017 | Journal Article | LibreCat-ID: 13412
Konieczna, D. D., Biller, H., Witte, M., Schmidt, W. G., Neuba, A., & Wilhelm, R. (2017). New pyridinium based ionic dyes for the hydrogen evolution reaction. Tetrahedron, 142–149. https://doi.org/10.1016/j.tet.2017.11.053
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| DOI
2017 | Journal Article | LibreCat-ID: 3435
Heinze, D., Zrenner, A., & Schumacher, S. (2017). Polarization-entangled twin photons from two-photon quantum-dot emission. Physical Review B, 24. https://doi.org/10.1103/PhysRevB.95.245306
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2017 | Journal Article | LibreCat-ID: 13359
Ma, X., Egorov, O. A., & Schumacher, S. (2017). Creation and Manipulation of Stable Dark Solitons and Vortices in Microcavity Polariton Condensates. Physical Review Letters, 118(15), Article 157401. https://doi.org/10.1103/physrevlett.118.157401
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| DOI
2017 | Journal Article | LibreCat-ID: 13358
Vollbrecht, J., Wiebeler, C., Schumacher, S., Bock, H., & Kitzerow, H.-S. (2017). Enhanced columnar mesophase range through distortions in arene cores. Molecular Crystals and Liquid Crystals, 66–73. https://doi.org/10.1080/15421406.2017.1284387
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2017 | Journal Article | LibreCat-ID: 13361
Lafont, O., Luk, S. M. H., Lewandowski, P., Kwong, N. H., Leung, P. T., Galopin, E., Lemaitre, A., Tignon, J., Schumacher, S., Baudin, E., & Binder, R. (2017). Controlling the optical spin Hall effect with light. Applied Physics Letters, Article 061108. https://doi.org/10.1063/1.4975681
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2017 | Journal Article | LibreCat-ID: 13356
Ma, X., & Schumacher, S. (2017). Vortex-vortex control in exciton-polariton condensates. Physical Review B, 95(23), Article 235301. https://doi.org/10.1103/physrevb.95.235301
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2017 | Journal Article | LibreCat-ID: 13803
Giannozzi, P., Andreussi, O., Brumme, T., Bunau, O., Buongiorno Nardelli, M., Calandra, M., Car, R., Cavazzoni, C., Ceresoli, D., Cococcioni, M., Colonna, N., Carnimeo, I., Dal Corso, A., de Gironcoli, S., Delugas, P., DiStasio, R. A., Ferretti, A., Floris, A., Fratesi, G., … Baroni, S. (2017). Advanced capabilities for materials modelling with Quantum ESPRESSO. Journal of Physics: Condensed Matter, 29(46), Article 465901. https://doi.org/10.1088/1361-648x/aa8f79
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 7481
Riefer, A., Weber, N., Mund, J., Yakovlev, D. R., Bayer, M., Schindlmayr, A., Meier, C., & Schmidt, W. G. (2017). Zn–VI quasiparticle gaps and optical spectra from many-body calculations. Journal of Physics: Condensed Matter, 29(21), Article 215702. https://doi.org/10.1088/1361-648x/aa6b2a
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| PubMed | Europe PMC
2017 | Journal Article | LibreCat-ID: 40389
Beltran, L., Frascella, G., Perez, A. M., Fickler, R., Sharapova, P., Manceau, M., Tikhonova, O. V., Boyd, R. W., Leuchs, G., & Chekhova, M. V. (2017). Orbital angular momentum modes of high-gain parametric down-conversion. Journal of Optics, 19(4), Article 044005. https://doi.org/10.1088/2040-8986/aa600f
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 40391
Balybin, S. N., Sharapova, P., & Tikhonova, O. V. (2017). Coherent control of atomic qubits by non-classical light. The European Physical Journal D, 71(5), Article 109. https://doi.org/10.1140/epjd/e2017-70712-y
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 13909
Salewski, M., Poltavtsev, S. V., Yugova, I. A., Karczewski, G., Wiater, M., Wojtowicz, T., Yakovlev, D. R., Akimov, I. A., Meier, T., & Bayer, M. (2017). High-Resolution Two-Dimensional Optical Spectroscopy of Electron Spins. Physical Review X, 7(3), Article 031030. https://doi.org/10.1103/physrevx.7.031030
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