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777 Publications
2020 | Journal Article | LibreCat-ID: 20583
Ma X, Kartashov YV, Gao T, Torner L, Schumacher S. Spiraling vortices in exciton-polariton condensates. Physical Review B. 2020;102(4):045309. doi:10.1103/PhysRevB.102.045309
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 19190 |

Schmidt F, Kozub AL, Biktagirov T, et al. Free and defect-bound (bi)polarons in LiNbO3: Atomic structure and spectroscopic signatures from ab initio calculations. Physical Review Research. 2020;2(4). doi:10.1103/PhysRevResearch.2.043002
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| WoS
2020 | Journal Article | LibreCat-ID: 29744
Rosenthal M, Lindner J, Gerstmann U, Meier A, Schmidt WG, Wilhelm R. A photoredox catalysed Heck reaction via hole transfer from a Ru(ii)-bis(terpyridine) complex to graphene oxide. RSC Advances. 2020;10(70):42930-42937. doi:10.1039/d0ra08749a
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 17066
Aldahhak H, Powroźnik P, Pander P, et al. Toward Efficient Toxic-Gas Detectors: Exploring Molecular Interactions of Sarin and Dimethyl Methylphosphonate with Metal-Centered Phthalocyanine Structures. The Journal of Physical Chemistry C. 2020;(124):6090-6102. doi:10.1021/acs.jpcc.9b11116
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| DOI
2020 | Journal Article | LibreCat-ID: 17068
Braun C, Neufeld S, Gerstmann U, et al. Vibration-Driven Self-Doping of Dangling-Bond Wires on Si(553)-Au Surfaces. Physical Review Letters. 2020;124(14). doi:10.1103/physrevlett.124.146802
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| DOI
2020 | Journal Article | LibreCat-ID: 17069
Biktagirov T, Schmidt WG, Gerstmann U. Spin decontamination for magnetic dipolar coupling calculations: Application to high-spin molecules and solid-state spin qubits. Physical Review Research. 2020;2(2). doi:10.1103/physrevresearch.2.022024
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 19194
Biktagirov T, Schmidt WG, Gerstmann U. Spin decontamination for magnetic dipolar coupling calculations: Application to high-spin molecules and solid-state spin qubits. Physical Review Research. Published online 2020. doi:10.1103/physrevresearch.2.022024
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| DOI
2020 | Journal Article | LibreCat-ID: 19193
Niederhausen J, MacQueen RW, Lips K, Aldahhak H, Schmidt WG, Gerstmann U. Tetracene Ultrathin Film Growth on Hydrogen-Passivated Silicon. Langmuir. Published online 2020:9099-9113. doi:10.1021/acs.langmuir.0c01154
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 19654
Krenz M, Gerstmann U, Schmidt WG. Photochemical Ring Opening of Oxirane Modeled by Constrained Density Functional Theory. ACS Omega. Published online 2020:24057-24063. doi:10.1021/acsomega.0c03483
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 22883
Zuo R, Song X, Meier T, Yang W. Carrier-wave population transfer in semiconductors. Journal of Physics: Conference Series. 2020;1412(8). doi:10.1088/1742-6596/1412/8/082005
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| DOI
2020 | Journal Article | LibreCat-ID: 40444
von Bardeleben HJ, Rauls E, Gerstmann U. Carbon vacancy-related centers in <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:mn>3</mml:mn><mml:mi>C</mml:mi></mml:math>-silicon carbide: Negative-<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:mi>U</mml:mi></mml:math> properties and structural transformation. Physical Review B. 2020;101(18). doi:10.1103/physrevb.101.184108
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 17070
Navickas M, Giriūnas L, Kalendra V, et al. Electron paramagnetic resonance study of ferroelectric phase transition and dynamic effects in a Mn2+ doped [NH4][Zn(HCOO)3] hybrid formate framework. Physical Chemistry Chemical Physics. 2020;22:8513-8521. doi:10.1039/d0cp01612h
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 29745
Biktagirov T, Gerstmann U. Spin-orbit driven electrical manipulation of the zero-field splitting in high-spin centers in solids. Physical Review Research. 2020;2(2). doi:10.1103/physrevresearch.2.023071
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 19189 |

Badalov S, Wilhelm R, Schmidt WG. Photocatalytic properties of graphene‐supported titania clusters from density‐functional theory. Journal of Computational Chemistry. Published online 2020:1921-1930. doi:10.1002/jcc.26363
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2020 | Conference Paper | LibreCat-ID: 20770
Hannes W-R, Meier T. k.p-based multiband simulations of non-degenerate two-photon absorption in bulk GaAs. In: Betz M, Elezzabi AY, eds. Ultrafast Phenomena and Nanophotonics XXIV. Vol 11278. SPIE Proceedings. ; 2020:112780S. doi:10.1117/12.2545924
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| DOI
2020 | Journal Article | LibreCat-ID: 20682
Bocchini A, Eigner C, Silberhorn C, Schmidt WG, Gerstmann U. Understanding gray track formation in KTP: Ti^3+ centers studied from first principles. Phys Rev Materials. 2020;4:124402. doi:10.1103/PhysRevMaterials.4.124402
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| DOI
2020 | Journal Article | LibreCat-ID: 22266
Grabo M, Staggenborg C, Philippi KA, Kenig E. Modeling and Optimization of Rectangular Latent Heat Storage Elements in an Air-Guided Heat Storage System. Frontiers in Energy Research. 2020;8. doi:10.3389/fenrg.2020.571787
LibreCat
| DOI
2020 | Journal Article | LibreCat-ID: 15945
Tinkloh SR, Wu T, Tröster T, Niendorf T. A micromechanical-based finite element simulation of process-induced residual stresses in metal-CFRP-hybrid structures. Composite Structures. 2020;238. doi:10.1016/j.compstruct.2020.111926
LibreCat
| DOI
2020 | Conference Paper | LibreCat-ID: 23409
Bertling R, Hack M, Ausner I, Kenig E. CFD Simulation of Film and Rivulet Flows on Microstructured Surfaces. In: ; 2020.
LibreCat
2020 | Journal Article | LibreCat-ID: 20580
Ma X, Berger B, Aßmann M, et al. Realization of all-optical vortex switching in exciton-polariton condensates. Nature Communications. 2020;11(1):897. doi:10.1038/s41467-020-14702-5
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