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737 Publications
2017 | Journal Article | LibreCat-ID: 13420
@article{Nozaki_Schmidt_2017, title={Current density analysis of electron transport through molecular wires in open quantum systems}, volume={38}, DOI={10.1002/jcc.24812}, journal={Journal of Computational Chemistry}, author={Nozaki, Daijiro and Schmidt, Wolf Gero}, year={2017}, pages={1685–1692} }
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 13421
@article{Landmann_Rauls_Schmidt_2017, title={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}, volume={95}, DOI={10.1103/physrevb.95.155310}, number={15}, journal={Physical Review B}, author={Landmann, M. and Rauls, E. and Schmidt, Wolf Gero}, year={2017} }
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 13422
@article{Witte_Rohrmüller_Gerstmann_Henkel_Schmidt_Herres-Pawlis_2017, title={[Cu6(NGuaS)6]2+ and its oxidized and reduced derivatives: Confining electrons on a torus}, DOI={10.1002/jcc.24798}, journal={Journal of Computational Chemistry}, author={Witte, Matthias and Rohrmüller, Martin and Gerstmann, Uwe and Henkel, Gerald and Schmidt, Wolf Gero and Herres-Pawlis, Sonja}, year={2017}, pages={1752–1761} }
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 13423
@article{Tebi_Paszkiewicz_Aldahhak_Allegretti_Gonglach_Haas_Waser_Deimel_Aguilar_Zhang_et al._2017, title={On-Surface Site-Selective Cyclization of Corrole Radicals}, DOI={10.1021/acsnano.7b00766}, journal={ACS Nano}, author={Tebi, Stefano and Paszkiewicz, Mateusz and Aldahhak, Hazem and Allegretti, Francesco and Gonglach, Sabrina and Haas, Michael and Waser, Mario and Deimel, Peter S. and Aguilar, Pablo Casado and Zhang, Yi-Qi and et al.}, year={2017}, pages={3383–3391} }
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 13424
@article{Aldahhak_Paszkiewicz_Allegretti_Duncan_Tebi_Deimel_Casado Aguilar_Zhang_Papageorgiou_Koch_et al._2017, title={X-ray Spectroscopy of Thin Film Free-Base Corroles: A Combined Theoretical and Experimental Characterization}, volume={121}, DOI={10.1021/acs.jpcc.6b09935}, journal={The Journal of Physical Chemistry C}, author={Aldahhak, Hazem and Paszkiewicz, M. and Allegretti, F. and Duncan, D. A. and Tebi, S. and Deimel, P. S. and Casado Aguilar, P. and Zhang, Y.-Q. and Papageorgiou, A. C. and Koch, R. and et al.}, year={2017}, pages={2192–2200} }
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 13425
@article{Rohrmüller_Schmidt_Gerstmann_2017, title={Electron paramagnetic resonance calculations for hydrogenated Si surfaces}, volume={95}, DOI={10.1103/physrevb.95.125310}, number={12}, journal={Physical Review B}, author={Rohrmüller, M. and Schmidt, Wolf Gero and Gerstmann, Uwe}, year={2017} }
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 13426
@article{Edler_Miccoli_Stöckmann_Pfnür_Braun_Neufeld_Sanna_Schmidt_Tegenkamp_2017, title={Tuning the conductivity along atomic chains by selective chemisorption}, volume={95}, DOI={10.1103/physrevb.95.125409}, number={12}, journal={Physical Review B}, author={Edler, F. and Miccoli, I. and Stöckmann, J. P. and Pfnür, H. and Braun, Christian and Neufeld, Sergej and Sanna, S. and Schmidt, Wolf Gero and Tegenkamp, C.}, year={2017} }
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 13427
@article{Nozaki_Lücke_Schmidt_2017, title={Molecular Orbital Rule for Quantum Interference in Weakly Coupled Dimers: Low-Energy Giant Conductivity Switching Induced by Orbital Level Crossing}, DOI={10.1021/acs.jpclett.6b02989}, journal={The Journal of Physical Chemistry Letters}, author={Nozaki, Daijiro and Lücke, Andreas and Schmidt, Wolf Gero}, year={2017}, pages={727–732} }
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 10020
@article{Landmann_Rauls_Schmidt_2017, title={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}, DOI={10.1103/physrevb.95.155310}, journal={Physical Review B}, author={Landmann, M. and Rauls, E. and Schmidt, Wolf Gero}, year={2017} }
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 10021 | 
@article{Friedrich_Schmidt_Schindlmayr_Sanna_2017, title={Optical properties of titanium-doped lithium niobate from time-dependent density-functional theory}, volume={1}, DOI={10.1103/PhysRevMaterials.1.034401}, number={3034401}, journal={Physical Review Materials}, publisher={American Physical Society}, author={Friedrich, Michael and Schmidt, Wolf Gero and Schindlmayr, Arno and Sanna, Simone}, year={2017} }
LibreCat
| Files available
| DOI
| WoS
2017 | Journal Article | LibreCat-ID: 10023 |
@article{Schmidt_Landmann_Rauls_Argiolas_Sanna_Schmidt_Schindlmayr_2017, title={Consistent atomic geometries and electronic structure of five phases of potassium niobate from density-functional theory}, volume={2017}, DOI={10.1155/2017/3981317}, number={3981317}, journal={Advances in Materials Science and Engineering}, publisher={Hindawi}, author={Schmidt, Falko and Landmann, Marc and Rauls, Eva and Argiolas, Nicola and Sanna, Simone and Schmidt, Wolf Gero and Schindlmayr, Arno}, year={2017} }
LibreCat
| Files available
| DOI
| WoS
2017 | Journal Article | LibreCat-ID: 13803
@article{Giannozzi_Andreussi_Brumme_Bunau_Buongiorno Nardelli_Calandra_Car_Cavazzoni_Ceresoli_Cococcioni_et al._2017, title={Advanced capabilities for materials modelling with Quantum ESPRESSO}, volume={29}, DOI={10.1088/1361-648x/aa8f79}, number={46465901}, journal={Journal of Physics: Condensed Matter}, author={Giannozzi, P and Andreussi, O and Brumme, T and Bunau, O and Buongiorno Nardelli, M and Calandra, M and Car, R and Cavazzoni, C and Ceresoli, D and Cococcioni, M and et al.}, year={2017} }
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 13359
@article{Ma_Egorov_Schumacher_2017, title={Creation and Manipulation of Stable Dark Solitons and Vortices in Microcavity Polariton Condensates}, volume={118}, DOI={10.1103/physrevlett.118.157401}, number={15157401}, journal={Physical Review Letters}, author={Ma, Xuekai and Egorov, Oleg A. and Schumacher, Stefan}, year={2017} }
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 13356
@article{Ma_Schumacher_2017, title={Vortex-vortex control in exciton-polariton condensates}, volume={95}, DOI={10.1103/physrevb.95.235301}, number={23235301}, journal={Physical Review B}, author={Ma, Xuekai and Schumacher, Stefan}, year={2017} }
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 13358
@article{Vollbrecht_Wiebeler_Schumacher_Bock_Kitzerow_2017, title={Enhanced columnar mesophase range through distortions in arene cores}, DOI={10.1080/15421406.2017.1284387}, journal={Molecular Crystals and Liquid Crystals}, author={Vollbrecht, Joachim and Wiebeler, Christian and Schumacher, Stefan and Bock, Harald and Kitzerow, Heinz-Siegfried}, year={2017}, pages={66–73} }
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 13289
@article{Yulin_Driben_Meier_2017, title={Bloch oscillations and resonant radiation of light propagating in arrays of nonlinear fibers with high-order dispersion}, volume={96}, DOI={10.1103/physreva.96.033827}, number={3033827}, journal={Physical Review A}, author={Yulin, A. and Driben, R. and Meier, Torsten}, year={2017} }
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 13332
@article{Podzimski_Duc_Meier_2017, title={Anisotropic excitons and their contributions to shift current transients in bulk GaAs}, volume={96}, DOI={10.1103/physrevb.96.205201}, number={20205201}, journal={Physical Review B}, author={Podzimski, Reinold and Duc, Huynh Thanh and Meier, Torsten}, year={2017} }
LibreCat
| DOI
2017 | Conference Paper | LibreCat-ID: 13334
@inproceedings{Podzimski_Duc_Meier_2017, series={SPIE Proceedings}, title={A microscopic approach to ultrafast near band gap photocurrents in bulk semiconductors}, volume={10102}, DOI={10.1117/12.2250299}, number={101020P}, booktitle={Ultrafast Phenomena and Nanophotonics XXI}, publisher={SPIE}, author={Podzimski, Reinold and Duc, Huynh Thanh and Meier, Torsten}, editor={Betz, Markus and Elezzabi, Abdulhakem Y.}, year={2017}, collection={SPIE Proceedings} }
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 13288
@article{Driben_Konotop_Meier_Yulin_2017, title={Bloch oscillations sustained by nonlinearity}, volume={7}, DOI={10.1038/s41598-017-03400-w}, number={13194}, journal={Scientific Reports}, author={Driben, R. and Konotop, V. V. and Meier, Torsten and Yulin, A. V.}, year={2017} }
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 16317
@article{Zimmer_Burkhardt_Friedrich_Steube_Neuba_Schepper_Müller_Flörke_Huber_Lochbrunner_et al._2017, title={The Connection between NHC Ligand Count and Photophysical Properties in Fe(II) Photosensitizers: An Experimental Study}, DOI={10.1021/acs.inorgchem.7b02624}, journal={Inorganic Chemistry}, author={Zimmer, Peter and Burkhardt, Lukas and Friedrich, Aleksej and Steube, Jakob and Neuba, Adam and Schepper, Rahel and Müller, Patrick and Flörke, Ulrich and Huber, Marina and Lochbrunner, Stefan and et al.}, year={2017}, pages={360–373} }
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