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A microscopic approach to ultrafast near band gap photocurrents in bulk semiconductors. In: Betz M, Elezzabi AY, eds. <i>Ultrafast Phenomena and Nanophotonics XXI</i>. Vol 10102. SPIE Proceedings. SPIE; 2017. doi:<a href=\"https://doi.org/10.1117/12.2250299\">10.1117/12.2250299</a>","mla":"Podzimski, Reinold, et al. “A Microscopic Approach to Ultrafast near Band Gap Photocurrents in Bulk Semiconductors.” <i>Ultrafast Phenomena and Nanophotonics XXI</i>, edited by Markus Betz and Abdulhakem Y. Elezzabi, vol. 10102, 101020P, SPIE, 2017, doi:<a href=\"https://doi.org/10.1117/12.2250299\">10.1117/12.2250299</a>.","chicago":"Podzimski, Reinold, Huynh Thanh Duc, and Torsten Meier. “A Microscopic Approach to Ultrafast near Band Gap Photocurrents in Bulk Semiconductors.” In <i>Ultrafast Phenomena and Nanophotonics XXI</i>, edited by Markus Betz and Abdulhakem Y. Elezzabi, Vol. 10102. SPIE Proceedings. 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Damping of Rabi oscillations in intensity-dependent photon echoes from exciton complexes in a CdTe/(Cd,Mg)Te single quantum well. <i>Physical Review B</i>, <i>96</i>(7), Article 075306. <a href=\"https://doi.org/10.1103/physrevb.96.075306\">https://doi.org/10.1103/physrevb.96.075306</a>","bibtex":"@article{Poltavtsev_Reichelt_Akimov_Karczewski_Wiater_Wojtowicz_Yakovlev_Meier_Bayer_2017, title={Damping of Rabi oscillations in intensity-dependent photon echoes from exciton complexes in a CdTe/(Cd,Mg)Te single quantum well}, volume={96}, DOI={<a href=\"https://doi.org/10.1103/physrevb.96.075306\">10.1103/physrevb.96.075306</a>}, number={7075306}, journal={Physical Review B}, author={Poltavtsev, S. V. and Reichelt, Matthias and Akimov, I. A. and Karczewski, G. and Wiater, M. and Wojtowicz, T. and Yakovlev, D. R. and Meier, Torsten and Bayer, M.}, year={2017} }","ama":"Poltavtsev SV, Reichelt M, Akimov IA, et al. Damping of Rabi oscillations in intensity-dependent photon echoes from exciton complexes in a CdTe/(Cd,Mg)Te single quantum well. <i>Physical Review B</i>. 2017;96(7). doi:<a href=\"https://doi.org/10.1103/physrevb.96.075306\">10.1103/physrevb.96.075306</a>","mla":"Poltavtsev, S. V., et al. “Damping of Rabi Oscillations in Intensity-Dependent Photon Echoes from Exciton Complexes in a CdTe/(Cd,Mg)Te Single Quantum Well.” <i>Physical Review B</i>, vol. 96, no. 7, 075306, 2017, doi:<a href=\"https://doi.org/10.1103/physrevb.96.075306\">10.1103/physrevb.96.075306</a>."},"user_id":"49063","volume":96,"_id":"13908","funded_apc":"1","status":"public"},{"volume":7,"user_id":"49063","_id":"13288","status":"public","project":[{"_id":"52","name":"Computing Resources Provided by the Paderborn Center for Parallel Computing"},{"_id":"53","name":"TRR 142"},{"_id":"56","name":"TRR 142 - Project Area C"},{"name":"TRR 142 - Subproject C2","_id":"72"}],"citation":{"apa":"Driben, R., Konotop, V. V., Meier, T., &#38; Yulin, A. V. (2017). Bloch oscillations sustained by nonlinearity. <i>Scientific Reports</i>, <i>7</i>(1), Article 3194. <a href=\"https://doi.org/10.1038/s41598-017-03400-w\">https://doi.org/10.1038/s41598-017-03400-w</a>","ieee":"R. Driben, V. V. Konotop, T. Meier, and A. V. Yulin, “Bloch oscillations sustained by nonlinearity,” <i>Scientific Reports</i>, vol. 7, no. 1, Art. no. 3194, 2017, doi: <a href=\"https://doi.org/10.1038/s41598-017-03400-w\">10.1038/s41598-017-03400-w</a>.","short":"R. Driben, V.V. Konotop, T. Meier, A.V. Yulin, Scientific Reports 7 (2017).","chicago":"Driben, R., V. V. Konotop, Torsten Meier, and A. V. Yulin. “Bloch Oscillations Sustained by Nonlinearity.” <i>Scientific Reports</i> 7, no. 1 (2017). <a href=\"https://doi.org/10.1038/s41598-017-03400-w\">https://doi.org/10.1038/s41598-017-03400-w</a>.","mla":"Driben, R., et al. “Bloch Oscillations Sustained by Nonlinearity.” <i>Scientific Reports</i>, vol. 7, no. 1, 3194, 2017, doi:<a href=\"https://doi.org/10.1038/s41598-017-03400-w\">10.1038/s41598-017-03400-w</a>.","ama":"Driben R, Konotop VV, Meier T, Yulin AV. Bloch oscillations sustained by nonlinearity. <i>Scientific Reports</i>. 2017;7(1). doi:<a href=\"https://doi.org/10.1038/s41598-017-03400-w\">10.1038/s41598-017-03400-w</a>","bibtex":"@article{Driben_Konotop_Meier_Yulin_2017, title={Bloch oscillations sustained by nonlinearity}, volume={7}, DOI={<a href=\"https://doi.org/10.1038/s41598-017-03400-w\">10.1038/s41598-017-03400-w</a>}, number={13194}, journal={Scientific Reports}, author={Driben, R. and Konotop, V. V. and Meier, Torsten and Yulin, A. V.}, year={2017} }"},"doi":"10.1038/s41598-017-03400-w","language":[{"iso":"eng"}],"article_number":"3194","intvolume":"         7","date_updated":"2023-04-16T21:01:03Z","publication_status":"published","author":[{"first_name":"R.","last_name":"Driben","full_name":"Driben, R."},{"first_name":"V. V.","last_name":"Konotop","full_name":"Konotop, V. V."},{"full_name":"Meier, Torsten","orcid":"0000-0001-8864-2072","first_name":"Torsten","last_name":"Meier","id":"344"},{"full_name":"Yulin, A. V.","last_name":"Yulin","first_name":"A. 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OMA of -16dBm at a BER of 10−4 is estimated at the photodiode for all channels. Each channel dissipates 330mW of power provided from a single 3.3V supply voltage.","lang":"eng"}],"related_material":{"link":[{"relation":"confirmation","url":"https://www.osapublishing.org/abstract.cfm?uri=FiO-2017-FM3A.3"}]},"citation":{"ama":"Gudyriev S, Scheytt C, Kress C, Yan L, Christian M, Zimmermann L. Fully-Differential, Hybrid, Multi-channel 4x25Gbps Direct Direction Receiver in 0.25\\textmum BiCMOS SiGe Technology. <i>OSA Frontiers in Optics + Laser Science</i>. Published online 2017. doi:<a href=\"https://doi.org/10.1364/FIO.2017.FM3A.3\">https://doi.org/10.1364/FIO.2017.FM3A.3</a>","bibtex":"@article{Gudyriev_Scheytt_Kress_Yan_Christian_Zimmermann_2017, title={Fully-Differential, Hybrid, Multi-channel 4x25Gbps Direct Direction Receiver in 0.25\\textmum BiCMOS SiGe Technology}, DOI={<a href=\"https://doi.org/10.1364/FIO.2017.FM3A.3\">https://doi.org/10.1364/FIO.2017.FM3A.3</a>}, journal={OSA Frontiers in Optics + Laser Science}, author={Gudyriev, Sergiy and Scheytt, Christoph and Kress, Christian and Yan, Lei and Christian, Meuer and Zimmermann, Lars}, year={2017} }","mla":"Gudyriev, Sergiy, et al. “Fully-Differential, Hybrid, Multi-Channel 4x25Gbps Direct Direction Receiver in 0.25\\textmum BiCMOS SiGe Technology.” <i>OSA Frontiers in Optics + Laser Science</i>, 2017, doi:<a href=\"https://doi.org/10.1364/FIO.2017.FM3A.3\">https://doi.org/10.1364/FIO.2017.FM3A.3</a>.","short":"S. Gudyriev, C. Scheytt, C. Kress, L. Yan, M. Christian, L. Zimmermann, OSA Frontiers in Optics + Laser Science (2017).","chicago":"Gudyriev, Sergiy, Christoph Scheytt, Christian Kress, Lei Yan, Meuer Christian, and Lars Zimmermann. “Fully-Differential, Hybrid, Multi-Channel 4x25Gbps Direct Direction Receiver in 0.25\\textmum BiCMOS SiGe Technology.” <i>OSA Frontiers in Optics + Laser Science</i>, 2017. <a href=\"https://doi.org/10.1364/FIO.2017.FM3A.3\">https://doi.org/10.1364/FIO.2017.FM3A.3</a>.","apa":"Gudyriev, S., Scheytt, C., Kress, C., Yan, L., Christian, M., &#38; Zimmermann, L. (2017). Fully-Differential, Hybrid, Multi-channel 4x25Gbps Direct Direction Receiver in 0.25\\textmum BiCMOS SiGe Technology. <i>OSA Frontiers in Optics + Laser Science</i>. <a href=\"https://doi.org/10.1364/FIO.2017.FM3A.3\">https://doi.org/10.1364/FIO.2017.FM3A.3</a>","ieee":"S. Gudyriev, C. Scheytt, C. Kress, L. Yan, M. Christian, and L. Zimmermann, “Fully-Differential, Hybrid, Multi-channel 4x25Gbps Direct Direction Receiver in 0.25\\textmum BiCMOS SiGe Technology,” <i>OSA Frontiers in Optics + Laser Science</i>, 2017, doi: <a href=\"https://doi.org/10.1364/FIO.2017.FM3A.3\">https://doi.org/10.1364/FIO.2017.FM3A.3</a>."},"publication":"OSA Frontiers in Optics + Laser Science"},{"status":"public","has_accepted_license":"1","_id":"10023","publisher":"Hindawi","volume":2017,"ddc":["530"],"user_id":"16199","citation":{"apa":"Schmidt, F., Landmann, M., Rauls, E., Argiolas, N., Sanna, S., Schmidt, W. G., &#38; Schindlmayr, A. (2017). Consistent atomic geometries and electronic structure of five phases of potassium niobate from density-functional theory. <i>Advances in Materials Science and Engineering</i>, <i>2017</i>, Article 3981317. <a href=\"https://doi.org/10.1155/2017/3981317\">https://doi.org/10.1155/2017/3981317</a>","ieee":"F. Schmidt <i>et al.</i>, “Consistent atomic geometries and electronic structure of five phases of potassium niobate from density-functional theory,” <i>Advances in Materials Science and Engineering</i>, vol. 2017, Art. no. 3981317, 2017, doi: <a href=\"https://doi.org/10.1155/2017/3981317\">10.1155/2017/3981317</a>.","short":"F. Schmidt, M. Landmann, E. Rauls, N. Argiolas, S. Sanna, W.G. Schmidt, A. Schindlmayr, Advances in Materials Science and Engineering 2017 (2017).","chicago":"Schmidt, Falko, Marc Landmann, Eva Rauls, Nicola Argiolas, Simone Sanna, Wolf Gero Schmidt, and Arno Schindlmayr. “Consistent Atomic Geometries and Electronic Structure of Five Phases of Potassium Niobate from Density-Functional Theory.” <i>Advances in Materials Science and Engineering</i> 2017 (2017). <a href=\"https://doi.org/10.1155/2017/3981317\">https://doi.org/10.1155/2017/3981317</a>.","mla":"Schmidt, Falko, et al. “Consistent Atomic Geometries and Electronic Structure of Five Phases of Potassium Niobate from Density-Functional Theory.” <i>Advances in Materials Science and Engineering</i>, vol. 2017, 3981317, Hindawi, 2017, doi:<a href=\"https://doi.org/10.1155/2017/3981317\">10.1155/2017/3981317</a>.","ama":"Schmidt F, Landmann M, Rauls E, et al. Consistent atomic geometries and electronic structure of five phases of potassium niobate from density-functional theory. <i>Advances in Materials Science and Engineering</i>. 2017;2017. doi:<a href=\"https://doi.org/10.1155/2017/3981317\">10.1155/2017/3981317</a>","bibtex":"@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={<a href=\"https://doi.org/10.1155/2017/3981317\">10.1155/2017/3981317</a>}, 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} }"},"isi":"1","file_date_updated":"2020-08-30T14:37:31Z","project":[{"_id":"52","name":"Computing Resources Provided by the Paderborn Center for Parallel Computing"},{"name":"TRR 142","_id":"53"},{"name":"TRR 142 - Project Area B","_id":"55"},{"name":"TRR 142 - Subproject B4","_id":"69"},{"name":"Computing Resources Provided by the Paderborn Center for Parallel Computing","_id":"52"}],"quality_controlled":"1","external_id":{"isi":["000394873300001"]},"oa":"1","publication_identifier":{"eissn":["1687-8442"],"issn":["1687-8434"]},"author":[{"id":"35251","full_name":"Schmidt, Falko","first_name":"Falko","last_name":"Schmidt","orcid":"0000-0002-5071-5528"},{"last_name":"Landmann","first_name":"Marc","full_name":"Landmann, Marc"},{"full_name":"Rauls, Eva","last_name":"Rauls","first_name":"Eva"},{"full_name":"Argiolas, Nicola","first_name":"Nicola","last_name":"Argiolas"},{"last_name":"Sanna","first_name":"Simone","full_name":"Sanna, Simone"},{"first_name":"Wolf Gero","last_name":"Schmidt","orcid":"0000-0002-2717-5076","full_name":"Schmidt, Wolf Gero","id":"468"},{"full_name":"Schindlmayr, Arno","orcid":"0000-0002-4855-071X","last_name":"Schindlmayr","first_name":"Arno","id":"458"}],"title":"Consistent atomic geometries and electronic structure of five phases of potassium niobate from density-functional theory","year":"2017","intvolume":"      2017","article_type":"original","date_updated":"2025-12-05T09:58:11Z","publication_status":"published","language":[{"iso":"eng"}],"article_number":"3981317","doi":"10.1155/2017/3981317","publication":"Advances in Materials Science and Engineering","abstract":[{"text":"We perform a comprehensive theoretical study of the structural and electronic properties of potassium niobate (KNbO3) in the cubic, tetragonal, orthorhombic, monoclinic, and rhombohedral phase, based on density-functional theory. The influence of different parametrizations of the exchange-correlation functional on the investigated properties is analyzed in detail, and the results are compared to available experimental data. We argue that the PBEsol and AM05 generalized gradient approximations as well as the RTPSS meta-generalized gradient approximation yield consistently accurate structural data for both the external and internal degrees of freedom and are overall superior to the local-density approximation or other conventional generalized gradient approximations for the structural characterization of KNbO3. Band-structure calculations using a HSE-type hybrid functional further indicate significant near degeneracies of band-edge states in all phases which are expected to be relevant for the optical response of the material.","lang":"eng"}],"date_created":"2019-05-29T07:48:32Z","file":[{"date_updated":"2020-08-30T14:37:31Z","relation":"main_file","access_level":"open_access","file_size":985948,"file_name":"3981317.pdf","title":"Consistent atomic geometries and electronic structure of five phases of potassium niobate from density-functional theory","content_type":"application/pdf","file_id":"18538","creator":"schindlm","description":"Creative Commons Attribution 4.0 International Public License (CC BY 4.0)","date_created":"2020-08-28T09:27:19Z"}],"department":[{"_id":"295"},{"_id":"296"},{"_id":"230"},{"_id":"429"},{"_id":"15"},{"_id":"35"},{"_id":"27"}],"type":"journal_article"},{"project":[{"_id":"52","name":"Computing Resources Provided by the Paderborn Center for Parallel Computing"}],"citation":{"bibtex":"@article{Lewandowski_Luk_Chan_Leung_Kwong_Binder_Schumacher_2017, title={Directional optical switching and transistor functionality using optical parametric oscillation in a spinor polariton fluid}, volume={25}, DOI={<a href=\"https://doi.org/10.1364/oe.25.031056\">10.1364/oe.25.031056</a>}, number={2531056}, journal={Optics Express}, author={Lewandowski, Przemyslaw and Luk, Samuel M. H. and Chan, Chris K. P. and Leung, P. T. and Kwong, N. H. and Binder, Rolf and Schumacher, Stefan}, year={2017} }","ama":"Lewandowski P, Luk SMH, Chan CKP, et al. Directional optical switching and transistor functionality using optical parametric oscillation in a spinor polariton fluid. <i>Optics Express</i>. 2017;25(25). doi:<a href=\"https://doi.org/10.1364/oe.25.031056\">10.1364/oe.25.031056</a>","mla":"Lewandowski, Przemyslaw, et al. “Directional Optical Switching and Transistor Functionality Using Optical Parametric Oscillation in a Spinor Polariton Fluid.” <i>Optics Express</i>, vol. 25, no. 25, 31056, 2017, doi:<a href=\"https://doi.org/10.1364/oe.25.031056\">10.1364/oe.25.031056</a>.","chicago":"Lewandowski, Przemyslaw, Samuel M. H. Luk, Chris K. P. Chan, P. T. Leung, N. H. Kwong, Rolf Binder, and Stefan Schumacher. “Directional Optical Switching and Transistor Functionality Using Optical Parametric Oscillation in a Spinor Polariton Fluid.” <i>Optics Express</i> 25, no. 25 (2017). <a href=\"https://doi.org/10.1364/oe.25.031056\">https://doi.org/10.1364/oe.25.031056</a>.","short":"P. Lewandowski, S.M.H. Luk, C.K.P. Chan, P.T. Leung, N.H. Kwong, R. Binder, S. Schumacher, Optics Express 25 (2017).","ieee":"P. Lewandowski <i>et al.</i>, “Directional optical switching and transistor functionality using optical parametric oscillation in a spinor polariton fluid,” <i>Optics Express</i>, vol. 25, no. 25, Art. no. 31056, 2017, doi: <a href=\"https://doi.org/10.1364/oe.25.031056\">10.1364/oe.25.031056</a>.","apa":"Lewandowski, P., Luk, S. M. H., Chan, C. K. P., Leung, P. T., Kwong, N. H., Binder, R., &#38; Schumacher, S. (2017). Directional optical switching and transistor functionality using optical parametric oscillation in a spinor polariton fluid. <i>Optics Express</i>, <i>25</i>(25), Article 31056. <a href=\"https://doi.org/10.1364/oe.25.031056\">https://doi.org/10.1364/oe.25.031056</a>"},"status":"public","user_id":"16199","volume":25,"_id":"13353","issue":"25","publication":"Optics Express","type":"journal_article","department":[{"_id":"15"},{"_id":"170"},{"_id":"297"},{"_id":"35"},{"_id":"230"},{"_id":"27"}],"date_created":"2019-09-19T13:58:49Z","publication_status":"published","date_updated":"2025-12-05T10:03:13Z","intvolume":"        25","title":"Directional optical switching and transistor functionality using optical parametric oscillation in a spinor polariton fluid","year":"2017","publication_identifier":{"issn":["1094-4087"]},"author":[{"first_name":"Przemyslaw","last_name":"Lewandowski","full_name":"Lewandowski, Przemyslaw"},{"full_name":"Luk, Samuel M. H.","first_name":"Samuel M. H.","last_name":"Luk"},{"full_name":"Chan, Chris K. P.","last_name":"Chan","first_name":"Chris K. P."},{"last_name":"Leung","first_name":"P. T.","full_name":"Leung, P. T."},{"first_name":"N. H.","last_name":"Kwong","full_name":"Kwong, N. H."},{"last_name":"Binder","first_name":"Rolf","full_name":"Binder, Rolf"},{"full_name":"Schumacher, Stefan","first_name":"Stefan","last_name":"Schumacher","orcid":"0000-0003-4042-4951","id":"27271"}],"doi":"10.1364/oe.25.031056","article_number":"31056","language":[{"iso":"eng"}]},{"department":[{"_id":"15"},{"_id":"170"},{"_id":"297"},{"_id":"35"},{"_id":"230"},{"_id":"27"}],"type":"journal_article","date_created":"2019-09-19T13:59:49Z","project":[{"_id":"52","name":"Computing Resources Provided by the Paderborn Center for Parallel Computing"}],"citation":{"ieee":"S. M. H. Luk, N. H. Kwong, P. Lewandowski, S. Schumacher, and R. Binder, “Optically Controlled Orbital Angular Momentum Generation in a Polaritonic Quantum Fluid,” <i>Physical Review Letters</i>, vol. 119, no. 11, 2017, doi: <a href=\"https://doi.org/10.1103/physrevlett.119.113903\">10.1103/physrevlett.119.113903</a>.","apa":"Luk, S. M. H., Kwong, N. H., Lewandowski, P., Schumacher, S., &#38; Binder, R. (2017). Optically Controlled Orbital Angular Momentum Generation in a Polaritonic Quantum Fluid. <i>Physical Review Letters</i>, <i>119</i>(11). <a href=\"https://doi.org/10.1103/physrevlett.119.113903\">https://doi.org/10.1103/physrevlett.119.113903</a>","chicago":"Luk, S. M. H., N. H. Kwong, P. Lewandowski, Stefan Schumacher, and R. Binder. “Optically Controlled Orbital Angular Momentum Generation in a Polaritonic Quantum Fluid.” <i>Physical Review Letters</i> 119, no. 11 (2017). <a href=\"https://doi.org/10.1103/physrevlett.119.113903\">https://doi.org/10.1103/physrevlett.119.113903</a>.","short":"S.M.H. Luk, N.H. Kwong, P. Lewandowski, S. Schumacher, R. Binder, Physical Review Letters 119 (2017).","mla":"Luk, S. M. H., et al. “Optically Controlled Orbital Angular Momentum Generation in a Polaritonic Quantum Fluid.” <i>Physical Review Letters</i>, vol. 119, no. 11, 2017, doi:<a href=\"https://doi.org/10.1103/physrevlett.119.113903\">10.1103/physrevlett.119.113903</a>.","bibtex":"@article{Luk_Kwong_Lewandowski_Schumacher_Binder_2017, title={Optically Controlled Orbital Angular Momentum Generation in a Polaritonic Quantum Fluid}, volume={119}, DOI={<a href=\"https://doi.org/10.1103/physrevlett.119.113903\">10.1103/physrevlett.119.113903</a>}, number={11}, journal={Physical Review Letters}, author={Luk, S. M. H. and Kwong, N. H. and Lewandowski, P. and Schumacher, Stefan and Binder, R.}, year={2017} }","ama":"Luk SMH, Kwong NH, Lewandowski P, Schumacher S, Binder R. Optically Controlled Orbital Angular Momentum Generation in a Polaritonic Quantum Fluid. <i>Physical Review Letters</i>. 2017;119(11). doi:<a href=\"https://doi.org/10.1103/physrevlett.119.113903\">10.1103/physrevlett.119.113903</a>"},"issue":"11","publication":"Physical Review Letters","volume":119,"user_id":"16199","doi":"10.1103/physrevlett.119.113903","_id":"13354","language":[{"iso":"eng"}],"intvolume":"       119","publication_status":"published","date_updated":"2025-12-05T10:02:42Z","author":[{"full_name":"Luk, S. M. H.","first_name":"S. M. H.","last_name":"Luk"},{"last_name":"Kwong","first_name":"N. H.","full_name":"Kwong, N. H."},{"full_name":"Lewandowski, P.","last_name":"Lewandowski","first_name":"P."},{"id":"27271","full_name":"Schumacher, Stefan","last_name":"Schumacher","first_name":"Stefan","orcid":"0000-0003-4042-4951"},{"first_name":"R.","last_name":"Binder","full_name":"Binder, R."}],"publication_identifier":{"issn":["0031-9007","1079-7114"]},"status":"public","title":"Optically Controlled Orbital Angular Momentum Generation in a Polaritonic Quantum Fluid","year":"2017"},{"publication_identifier":{"issn":["1948-7185"]},"author":[{"first_name":"Christian","last_name":"Wiebeler","full_name":"Wiebeler, Christian"},{"full_name":"Plasser, Felix","last_name":"Plasser","first_name":"Felix"},{"first_name":"Gordon J.","last_name":"Hedley","full_name":"Hedley, Gordon J."},{"full_name":"Ruseckas, Arvydas","last_name":"Ruseckas","first_name":"Arvydas"},{"full_name":"Samuel, Ifor D. W.","last_name":"Samuel","first_name":"Ifor D. W."},{"full_name":"Schumacher, Stefan","first_name":"Stefan","last_name":"Schumacher","orcid":"0000-0003-4042-4951","id":"27271"}],"year":"2017","status":"public","title":"Ultrafast Electronic Energy Transfer in an Orthogonal Molecular Dyad","date_updated":"2025-12-05T10:02:19Z","publication_status":"published","language":[{"iso":"eng"}],"_id":"13360","page":"1086-1092","doi":"10.1021/acs.jpclett.7b00089","user_id":"16199","citation":{"apa":"Wiebeler, C., Plasser, F., Hedley, G. J., Ruseckas, A., Samuel, I. D. W., &#38; Schumacher, S. (2017). Ultrafast Electronic Energy Transfer in an Orthogonal Molecular Dyad. <i>The Journal of Physical Chemistry Letters</i>, 1086–1092. <a href=\"https://doi.org/10.1021/acs.jpclett.7b00089\">https://doi.org/10.1021/acs.jpclett.7b00089</a>","ieee":"C. Wiebeler, F. Plasser, G. J. Hedley, A. Ruseckas, I. D. W. Samuel, and S. Schumacher, “Ultrafast Electronic Energy Transfer in an Orthogonal Molecular Dyad,” <i>The Journal of Physical Chemistry Letters</i>, pp. 1086–1092, 2017, doi: <a href=\"https://doi.org/10.1021/acs.jpclett.7b00089\">10.1021/acs.jpclett.7b00089</a>.","short":"C. Wiebeler, F. Plasser, G.J. Hedley, A. Ruseckas, I.D.W. Samuel, S. Schumacher, The Journal of Physical Chemistry Letters (2017) 1086–1092.","chicago":"Wiebeler, Christian, Felix Plasser, Gordon J. Hedley, Arvydas Ruseckas, Ifor D. W. Samuel, and Stefan Schumacher. “Ultrafast Electronic Energy Transfer in an Orthogonal Molecular Dyad.” <i>The Journal of Physical Chemistry Letters</i>, 2017, 1086–92. <a href=\"https://doi.org/10.1021/acs.jpclett.7b00089\">https://doi.org/10.1021/acs.jpclett.7b00089</a>.","mla":"Wiebeler, Christian, et al. “Ultrafast Electronic Energy Transfer in an Orthogonal Molecular Dyad.” <i>The Journal of Physical Chemistry Letters</i>, 2017, pp. 1086–92, doi:<a href=\"https://doi.org/10.1021/acs.jpclett.7b00089\">10.1021/acs.jpclett.7b00089</a>.","ama":"Wiebeler C, Plasser F, Hedley GJ, Ruseckas A, Samuel IDW, Schumacher S. Ultrafast Electronic Energy Transfer in an Orthogonal Molecular Dyad. <i>The Journal of Physical Chemistry Letters</i>. Published online 2017:1086-1092. doi:<a href=\"https://doi.org/10.1021/acs.jpclett.7b00089\">10.1021/acs.jpclett.7b00089</a>","bibtex":"@article{Wiebeler_Plasser_Hedley_Ruseckas_Samuel_Schumacher_2017, title={Ultrafast Electronic Energy Transfer in an Orthogonal Molecular Dyad}, DOI={<a href=\"https://doi.org/10.1021/acs.jpclett.7b00089\">10.1021/acs.jpclett.7b00089</a>}, journal={The Journal of Physical Chemistry Letters}, author={Wiebeler, Christian and Plasser, Felix and Hedley, Gordon J. and Ruseckas, Arvydas and Samuel, Ifor D. W. and Schumacher, Stefan}, year={2017}, pages={1086–1092} }"},"publication":"The Journal of Physical Chemistry Letters","project":[{"_id":"52","name":"Computing Resources Provided by the Paderborn Center for Parallel Computing"}],"date_created":"2019-09-19T14:21:34Z","department":[{"_id":"15"},{"_id":"170"},{"_id":"297"},{"_id":"230"},{"_id":"35"},{"_id":"27"}],"type":"journal_article"},{"oa":"1","external_id":{"isi":["000416562300001"]},"project":[{"name":"Computing Resources Provided by the Paderborn Center for Parallel Computing","_id":"52"},{"_id":"53","name":"TRR 142"},{"name":"TRR 142 - Project Area B","_id":"55"},{"_id":"69","name":"TRR 142 - Subproject B4"},{"name":"TRR 142 - Subproject B3","_id":"68"}],"quality_controlled":"1","isi":"1","citation":{"mla":"Friedrich, Michael, et al. “Optical Properties of Titanium-Doped Lithium Niobate from Time-Dependent Density-Functional Theory.” <i>Physical Review Materials</i>, vol. 1, no. 3, 034401, American Physical Society, 2017, doi:<a href=\"https://doi.org/10.1103/PhysRevMaterials.1.034401\">10.1103/PhysRevMaterials.1.034401</a>.","bibtex":"@article{Friedrich_Schmidt_Schindlmayr_Sanna_2017, title={Optical properties of titanium-doped lithium niobate from time-dependent density-functional theory}, volume={1}, DOI={<a href=\"https://doi.org/10.1103/PhysRevMaterials.1.034401\">10.1103/PhysRevMaterials.1.034401</a>}, 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} }","ama":"Friedrich M, Schmidt WG, Schindlmayr A, Sanna S. Optical properties of titanium-doped lithium niobate from time-dependent density-functional theory. <i>Physical Review Materials</i>. 2017;1(3). doi:<a href=\"https://doi.org/10.1103/PhysRevMaterials.1.034401\">10.1103/PhysRevMaterials.1.034401</a>","ieee":"M. Friedrich, W. G. Schmidt, A. Schindlmayr, and S. Sanna, “Optical properties of titanium-doped lithium niobate from time-dependent density-functional theory,” <i>Physical Review Materials</i>, vol. 1, no. 3, Art. no. 034401, 2017, doi: <a href=\"https://doi.org/10.1103/PhysRevMaterials.1.034401\">10.1103/PhysRevMaterials.1.034401</a>.","apa":"Friedrich, M., Schmidt, W. G., Schindlmayr, A., &#38; Sanna, S. (2017). Optical properties of titanium-doped lithium niobate from time-dependent density-functional theory. <i>Physical Review Materials</i>, <i>1</i>(3), Article 034401. <a href=\"https://doi.org/10.1103/PhysRevMaterials.1.034401\">https://doi.org/10.1103/PhysRevMaterials.1.034401</a>","short":"M. Friedrich, W.G. Schmidt, A. Schindlmayr, S. Sanna, Physical Review Materials 1 (2017).","chicago":"Friedrich, Michael, Wolf Gero Schmidt, Arno Schindlmayr, and Simone Sanna. “Optical Properties of Titanium-Doped Lithium Niobate from Time-Dependent Density-Functional Theory.” <i>Physical Review Materials</i> 1, no. 3 (2017). <a href=\"https://doi.org/10.1103/PhysRevMaterials.1.034401\">https://doi.org/10.1103/PhysRevMaterials.1.034401</a>."},"file_date_updated":"2020-08-30T14:36:11Z","volume":1,"user_id":"16199","ddc":["530"],"_id":"10021","publisher":"American Physical Society","has_accepted_license":"1","status":"public","department":[{"_id":"295"},{"_id":"296"},{"_id":"230"},{"_id":"429"},{"_id":"35"},{"_id":"27"}],"type":"journal_article","date_created":"2019-05-29T07:42:33Z","file":[{"file_id":"18467","content_type":"application/pdf","title":"Optical properties of titanium-doped lithium niobate from time-dependent density-functional theory","file_name":"PhysRevMaterials.1.034401.pdf","file_size":708075,"access_level":"open_access","relation":"main_file","date_updated":"2020-08-30T14:36:11Z","date_created":"2020-08-27T19:39:54Z","description":"© 2017 American Physical Society","creator":"schindlm"}],"related_material":{"record":[{"status":"public","id":"13410","relation":"other"}]},"abstract":[{"text":"The optical properties of pristine and titanium-doped LiNbO3 are modeled from first principles. The dielectric functions are calculated within time-dependent density-functional theory, and a model long-range contribution is employed for the exchange-correlation kernel in order to account for the electron-hole binding. Our study focuses on the influence of substitutional titanium atoms on lithium sites. We show that an increasing titanium concentration enhances the values of the refractive indices and the reflectivity.","lang":"eng"}],"issue":"3","publication":"Physical Review Materials","doi":"10.1103/PhysRevMaterials.1.034401","language":[{"iso":"eng"}],"article_number":"034401","article_type":"original","intvolume":"         1","publication_status":"published","date_updated":"2025-12-05T10:07:07Z","publication_identifier":{"issn":["2475-9953"]},"author":[{"full_name":"Friedrich, Michael","first_name":"Michael","last_name":"Friedrich"},{"id":"468","first_name":"Wolf Gero","orcid":"0000-0002-2717-5076","last_name":"Schmidt","full_name":"Schmidt, Wolf Gero"},{"first_name":"Arno","orcid":"0000-0002-4855-071X","last_name":"Schindlmayr","full_name":"Schindlmayr, Arno","id":"458"},{"last_name":"Sanna","first_name":"Simone","full_name":"Sanna, Simone"}],"title":"Optical properties of titanium-doped lithium niobate from time-dependent density-functional theory","year":"2017"},{"publication":"The Journal of Physical Chemistry C","type":"journal_article","department":[{"_id":"15"},{"_id":"170"},{"_id":"295"},{"_id":"790"},{"_id":"35"},{"_id":"230"},{"_id":"27"}],"date_created":"2019-09-20T12:14:02Z","publication_status":"published","date_updated":"2025-12-05T10:09:30Z","intvolume":"       121","title":"X-ray Spectroscopy of Thin Film Free-Base Corroles: A Combined Theoretical and Experimental Characterization","year":"2017","publication_identifier":{"issn":["1932-7447","1932-7455"]},"author":[{"full_name":"Aldahhak, Hazem","last_name":"Aldahhak","first_name":"Hazem","id":"26687"},{"first_name":"M.","last_name":"Paszkiewicz","full_name":"Paszkiewicz, M."},{"full_name":"Allegretti, F.","last_name":"Allegretti","first_name":"F."},{"full_name":"Duncan, D. A.","last_name":"Duncan","first_name":"D. A."},{"first_name":"S.","last_name":"Tebi","full_name":"Tebi, S."},{"full_name":"Deimel, P. S.","last_name":"Deimel","first_name":"P. S."},{"first_name":"P.","last_name":"Casado Aguilar","full_name":"Casado Aguilar, P."},{"first_name":"Y.-Q.","last_name":"Zhang","full_name":"Zhang, Y.-Q."},{"first_name":"A. C.","last_name":"Papageorgiou","full_name":"Papageorgiou, A. C."},{"full_name":"Koch, R.","last_name":"Koch","first_name":"R."},{"full_name":"Barth, J. V.","first_name":"J. V.","last_name":"Barth"},{"full_name":"Schmidt, Wolf Gero","first_name":"Wolf Gero","last_name":"Schmidt","orcid":"0000-0002-2717-5076","id":"468"},{"first_name":"S.","last_name":"Müllegger","full_name":"Müllegger, S."},{"full_name":"Schöfberger, W.","first_name":"W.","last_name":"Schöfberger"},{"full_name":"Klappenberger, F.","first_name":"F.","last_name":"Klappenberger"},{"full_name":"Rauls, E.","first_name":"E.","last_name":"Rauls"},{"full_name":"Gerstmann, Uwe","last_name":"Gerstmann","first_name":"Uwe","orcid":"0000-0002-4476-223X","id":"171"}],"doi":"10.1021/acs.jpcc.6b09935","language":[{"iso":"eng"}],"project":[{"_id":"52","name":"Computing Resources Provided by the Paderborn Center for Parallel Computing"}],"citation":{"short":"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.","chicago":"Aldahhak, Hazem, M. Paszkiewicz, F. Allegretti, D. A. Duncan, S. Tebi, P. S. Deimel, P. Casado Aguilar, et al. “X-Ray Spectroscopy of Thin Film Free-Base Corroles: A Combined Theoretical and Experimental Characterization.” <i>The Journal of Physical Chemistry C</i> 121 (2017): 2192–2200. <a href=\"https://doi.org/10.1021/acs.jpcc.6b09935\">https://doi.org/10.1021/acs.jpcc.6b09935</a>.","apa":"Aldahhak, H., Paszkiewicz, M., Allegretti, F., Duncan, D. A., Tebi, S., Deimel, P. S., Casado Aguilar, P., Zhang, Y.-Q., Papageorgiou, A. C., Koch, R., Barth, J. V., Schmidt, W. G., Müllegger, S., Schöfberger, W., Klappenberger, F., Rauls, E., &#38; Gerstmann, U. (2017). X-ray Spectroscopy of Thin Film Free-Base Corroles: A Combined Theoretical and Experimental Characterization. <i>The Journal of Physical Chemistry C</i>, <i>121</i>, 2192–2200. <a href=\"https://doi.org/10.1021/acs.jpcc.6b09935\">https://doi.org/10.1021/acs.jpcc.6b09935</a>","ieee":"H. Aldahhak <i>et al.</i>, “X-ray Spectroscopy of Thin Film Free-Base Corroles: A Combined Theoretical and Experimental Characterization,” <i>The Journal of Physical Chemistry C</i>, vol. 121, pp. 2192–2200, 2017, doi: <a href=\"https://doi.org/10.1021/acs.jpcc.6b09935\">10.1021/acs.jpcc.6b09935</a>.","ama":"Aldahhak H, Paszkiewicz M, Allegretti F, et al. 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