[{"issue":"7","publication":"The Journal of Physical Chemistry C","department":[{"_id":"15"},{"_id":"170"},{"_id":"297"},{"_id":"313"},{"_id":"230"},{"_id":"35"},{"_id":"27"},{"_id":"2"}],"type":"journal_article","date_created":"2019-09-19T13:36:01Z","intvolume":"       123","date_updated":"2025-12-05T14:29:56Z","publication_status":"published","publication_identifier":{"issn":["1932-7447","1932-7455"]},"author":[{"full_name":"Vollbrecht, Joachim","last_name":"Vollbrecht","first_name":"Joachim"},{"last_name":"Wiebeler","first_name":"Christian","full_name":"Wiebeler, Christian"},{"first_name":"Harald","last_name":"Bock","full_name":"Bock, Harald"},{"full_name":"Schumacher, Stefan","first_name":"Stefan","last_name":"Schumacher","orcid":"0000-0003-4042-4951","id":"27271"},{"id":"254","first_name":"Heinz-Siegfried","last_name":"Kitzerow","full_name":"Kitzerow, Heinz-Siegfried"}],"year":"2019","title":"Curved Polar Dibenzocoronene Esters and Imides versus Their Planar Centrosymmetric Homologs: Photophysical and Optoelectronic Analysis","doi":"10.1021/acs.jpcc.8b10730","language":[{"iso":"eng"}],"project":[{"_id":"52","name":"Computing Resources Provided by the Paderborn Center for Parallel Computing"}],"citation":{"bibtex":"@article{Vollbrecht_Wiebeler_Bock_Schumacher_Kitzerow_2019, title={Curved Polar Dibenzocoronene Esters and Imides versus Their Planar Centrosymmetric Homologs: Photophysical and Optoelectronic Analysis}, volume={123}, DOI={<a href=\"https://doi.org/10.1021/acs.jpcc.8b10730\">10.1021/acs.jpcc.8b10730</a>}, number={7}, journal={The Journal of Physical Chemistry C}, author={Vollbrecht, Joachim and Wiebeler, Christian and Bock, Harald and Schumacher, Stefan and Kitzerow, Heinz-Siegfried}, year={2019}, pages={4483–4492} }","ama":"Vollbrecht J, Wiebeler C, Bock H, Schumacher S, Kitzerow H-S. Curved Polar Dibenzocoronene Esters and Imides versus Their Planar Centrosymmetric Homologs: Photophysical and Optoelectronic Analysis. <i>The Journal of Physical Chemistry C</i>. 2019;123(7):4483-4492. doi:<a href=\"https://doi.org/10.1021/acs.jpcc.8b10730\">10.1021/acs.jpcc.8b10730</a>","mla":"Vollbrecht, Joachim, et al. “Curved Polar Dibenzocoronene Esters and Imides versus Their Planar Centrosymmetric Homologs: Photophysical and Optoelectronic Analysis.” <i>The Journal of Physical Chemistry C</i>, vol. 123, no. 7, 2019, pp. 4483–92, doi:<a href=\"https://doi.org/10.1021/acs.jpcc.8b10730\">10.1021/acs.jpcc.8b10730</a>.","short":"J. Vollbrecht, C. Wiebeler, H. Bock, S. Schumacher, H.-S. Kitzerow, The Journal of Physical Chemistry C 123 (2019) 4483–4492.","chicago":"Vollbrecht, Joachim, Christian Wiebeler, Harald Bock, Stefan Schumacher, and Heinz-Siegfried Kitzerow. “Curved Polar Dibenzocoronene Esters and Imides versus Their Planar Centrosymmetric Homologs: Photophysical and Optoelectronic Analysis.” <i>The Journal of Physical Chemistry C</i> 123, no. 7 (2019): 4483–92. <a href=\"https://doi.org/10.1021/acs.jpcc.8b10730\">https://doi.org/10.1021/acs.jpcc.8b10730</a>.","ieee":"J. Vollbrecht, C. Wiebeler, H. Bock, S. Schumacher, and H.-S. Kitzerow, “Curved Polar Dibenzocoronene Esters and Imides versus Their Planar Centrosymmetric Homologs: Photophysical and Optoelectronic Analysis,” <i>The Journal of Physical Chemistry C</i>, vol. 123, no. 7, pp. 4483–4492, 2019, doi: <a href=\"https://doi.org/10.1021/acs.jpcc.8b10730\">10.1021/acs.jpcc.8b10730</a>.","apa":"Vollbrecht, J., Wiebeler, C., Bock, H., Schumacher, S., &#38; Kitzerow, H.-S. (2019). Curved Polar Dibenzocoronene Esters and Imides versus Their Planar Centrosymmetric Homologs: Photophysical and Optoelectronic Analysis. <i>The Journal of Physical Chemistry C</i>, <i>123</i>(7), 4483–4492. <a href=\"https://doi.org/10.1021/acs.jpcc.8b10730\">https://doi.org/10.1021/acs.jpcc.8b10730</a>"},"status":"public","volume":123,"user_id":"16199","_id":"13343","page":"4483-4492"},{"publication_identifier":{"issn":["1932-7447","1932-7455"]},"author":[{"full_name":"Badalov, S. V.","first_name":"S. V.","last_name":"Badalov"},{"full_name":"Yagmurcukardes, M.","first_name":"M.","last_name":"Yagmurcukardes"},{"last_name":"Peeters","first_name":"F. M.","full_name":"Peeters, F. M."},{"first_name":"H.","last_name":"Sahin","full_name":"Sahin, H."}],"year":"2018","title":"Enhanced Stability of Single-Layer w-Gallenene through Hydrogenation","status":"public","publication_status":"published","date_updated":"2022-01-06T06:54:00Z","_id":"19214","language":[{"iso":"eng"}],"page":"28302-28309","user_id":"78800","doi":"10.1021/acs.jpcc.8b07353","citation":{"mla":"Badalov, S. V., et al. “Enhanced Stability of Single-Layer w-Gallenene through Hydrogenation.” <i>The Journal of Physical Chemistry C</i>, 2018, pp. 28302–09, doi:<a href=\"https://doi.org/10.1021/acs.jpcc.8b07353\">10.1021/acs.jpcc.8b07353</a>.","ama":"Badalov SV, Yagmurcukardes M, Peeters FM, Sahin H. Enhanced Stability of Single-Layer w-Gallenene through Hydrogenation. <i>The Journal of Physical Chemistry C</i>. 2018:28302-28309. doi:<a href=\"https://doi.org/10.1021/acs.jpcc.8b07353\">10.1021/acs.jpcc.8b07353</a>","bibtex":"@article{Badalov_Yagmurcukardes_Peeters_Sahin_2018, title={Enhanced Stability of Single-Layer w-Gallenene through Hydrogenation}, DOI={<a href=\"https://doi.org/10.1021/acs.jpcc.8b07353\">10.1021/acs.jpcc.8b07353</a>}, journal={The Journal of Physical Chemistry C}, author={Badalov, S. V. and Yagmurcukardes, M. and Peeters, F. M. and Sahin, H.}, year={2018}, pages={28302–28309} }","apa":"Badalov, S. V., Yagmurcukardes, M., Peeters, F. M., &#38; Sahin, H. (2018). Enhanced Stability of Single-Layer w-Gallenene through Hydrogenation. <i>The Journal of Physical Chemistry C</i>, 28302–28309. <a href=\"https://doi.org/10.1021/acs.jpcc.8b07353\">https://doi.org/10.1021/acs.jpcc.8b07353</a>","ieee":"S. V. Badalov, M. Yagmurcukardes, F. M. Peeters, and H. Sahin, “Enhanced Stability of Single-Layer w-Gallenene through Hydrogenation,” <i>The Journal of Physical Chemistry C</i>, pp. 28302–28309, 2018.","short":"S.V. Badalov, M. Yagmurcukardes, F.M. Peeters, H. Sahin, The Journal of Physical Chemistry C (2018) 28302–28309.","chicago":"Badalov, S. V., M. Yagmurcukardes, F. M. Peeters, and H. Sahin. “Enhanced Stability of Single-Layer w-Gallenene through Hydrogenation.” <i>The Journal of Physical Chemistry C</i>, 2018, 28302–9. <a href=\"https://doi.org/10.1021/acs.jpcc.8b07353\">https://doi.org/10.1021/acs.jpcc.8b07353</a>."},"publication":"The Journal of Physical Chemistry C","extern":"1","date_created":"2020-09-09T15:53:54Z","type":"journal_article"},{"publication":"The Journal of Physical Chemistry C","issue":"8","date_created":"2018-03-23T13:12:39Z","type":"journal_article","department":[{"_id":"15"},{"_id":"230"},{"_id":"313"}],"title":"Switchable Plasmonic Holograms Utilizing the Electro-Optic Effect of a Liquid-Crystal Circular Polarizer","year":"2018","author":[{"last_name":"Atorf","first_name":"Bernhard","full_name":"Atorf, Bernhard"},{"full_name":"Rasouli, Hoda","first_name":"Hoda","last_name":"Rasouli"},{"last_name":"Mühlenbernd","first_name":"Holger","full_name":"Mühlenbernd, Holger"},{"first_name":"Bernhard J.","last_name":"Reineke","full_name":"Reineke, Bernhard J."},{"id":"30525","last_name":"Zentgraf","first_name":"Thomas","orcid":"0000-0002-8662-1101","full_name":"Zentgraf, Thomas"},{"first_name":"Heinz-Siegfried","last_name":"Kitzerow","full_name":"Kitzerow, Heinz-Siegfried","id":"254"}],"publication_identifier":{"issn":["1932-7447","1932-7455"]},"date_updated":"2023-01-10T13:17:01Z","publication_status":"published","intvolume":"       122","language":[{"iso":"eng"}],"doi":"10.1021/acs.jpcc.7b12609","citation":{"mla":"Atorf, Bernhard, et al. “Switchable Plasmonic Holograms Utilizing the Electro-Optic Effect of a Liquid-Crystal Circular Polarizer.” <i>The Journal of Physical Chemistry C</i>, vol. 122, no. 8, American Chemical Society (ACS), 2018, pp. 4600–06, doi:<a href=\"https://doi.org/10.1021/acs.jpcc.7b12609\">10.1021/acs.jpcc.7b12609</a>.","ama":"Atorf B, Rasouli H, Mühlenbernd H, Reineke BJ, Zentgraf T, Kitzerow H-S. Switchable Plasmonic Holograms Utilizing the Electro-Optic Effect of a Liquid-Crystal Circular Polarizer. <i>The Journal of Physical Chemistry C</i>. 2018;122(8):4600-4606. doi:<a href=\"https://doi.org/10.1021/acs.jpcc.7b12609\">10.1021/acs.jpcc.7b12609</a>","bibtex":"@article{Atorf_Rasouli_Mühlenbernd_Reineke_Zentgraf_Kitzerow_2018, title={Switchable Plasmonic Holograms Utilizing the Electro-Optic Effect of a Liquid-Crystal Circular Polarizer}, volume={122}, DOI={<a href=\"https://doi.org/10.1021/acs.jpcc.7b12609\">10.1021/acs.jpcc.7b12609</a>}, number={8}, journal={The Journal of Physical Chemistry C}, publisher={American Chemical Society (ACS)}, author={Atorf, Bernhard and Rasouli, Hoda and Mühlenbernd, Holger and Reineke, Bernhard J. and Zentgraf, Thomas and Kitzerow, Heinz-Siegfried}, year={2018}, pages={4600–4606} }","apa":"Atorf, B., Rasouli, H., Mühlenbernd, H., Reineke, B. J., Zentgraf, T., &#38; Kitzerow, H.-S. (2018). Switchable Plasmonic Holograms Utilizing the Electro-Optic Effect of a Liquid-Crystal Circular Polarizer. <i>The Journal of Physical Chemistry C</i>, <i>122</i>(8), 4600–4606. <a href=\"https://doi.org/10.1021/acs.jpcc.7b12609\">https://doi.org/10.1021/acs.jpcc.7b12609</a>","ieee":"B. Atorf, H. Rasouli, H. Mühlenbernd, B. J. Reineke, T. Zentgraf, and H.-S. Kitzerow, “Switchable Plasmonic Holograms Utilizing the Electro-Optic Effect of a Liquid-Crystal Circular Polarizer,” <i>The Journal of Physical Chemistry C</i>, vol. 122, no. 8, pp. 4600–4606, 2018, doi: <a href=\"https://doi.org/10.1021/acs.jpcc.7b12609\">10.1021/acs.jpcc.7b12609</a>.","short":"B. Atorf, H. Rasouli, H. Mühlenbernd, B.J. Reineke, T. Zentgraf, H.-S. Kitzerow, The Journal of Physical Chemistry C 122 (2018) 4600–4606.","chicago":"Atorf, Bernhard, Hoda Rasouli, Holger Mühlenbernd, Bernhard J. Reineke, Thomas Zentgraf, and Heinz-Siegfried Kitzerow. “Switchable Plasmonic Holograms Utilizing the Electro-Optic Effect of a Liquid-Crystal Circular Polarizer.” <i>The Journal of Physical Chemistry C</i> 122, no. 8 (2018): 4600–4606. <a href=\"https://doi.org/10.1021/acs.jpcc.7b12609\">https://doi.org/10.1021/acs.jpcc.7b12609</a>."},"status":"public","page":"4600-4606","_id":"1764","publisher":"American Chemical Society (ACS)","user_id":"14931","volume":122},{"doi":"10.1021/acs.jpcc.7b05655","user_id":"70093","page":"15294-15303","_id":"26106","language":[{"iso":"eng"}],"date_updated":"2022-01-06T06:57:16Z","publication_status":"published","title":"Dependencies of the Adhesion Forces between TiO2 Nanoparticles on Size and Ambient Humidity","year":"2017","status":"public","publication_identifier":{"issn":["1932-7447","1932-7455"]},"author":[{"last_name":"Laube","first_name":"Jens","full_name":"Laube, Jens"},{"last_name":"Dörmann","first_name":"Michael","full_name":"Dörmann, Michael"},{"full_name":"Schmid, Hans-Joachim","first_name":"Hans-Joachim","last_name":"Schmid","id":"464"},{"full_name":"Mädler, Lutz","first_name":"Lutz","last_name":"Mädler"},{"last_name":"Colombi Ciacchi","first_name":"Lucio","full_name":"Colombi Ciacchi, Lucio"}],"type":"journal_article","date_created":"2021-10-13T13:31:20Z","abstract":[{"lang":"eng","text":"We study the variation of the adhesion forces between wet TiO2 nanoparticles as a function of their size and the ambient relative humidity. Combining all-atom molecular dynamics and capillary simulations we demonstrate that the linear scaling of the interparticle forces with the particle diameter, well established for microscopic and macroscopic particles, can be extended down to diameters of a few nm. At this size scale, however, the molecular nature of the water adsorbates dictates the adhesion forces both via solvation effects and influencing parameters of analytical capillary models such as the equilibrium particle–particle separation distance and the water/particle contact angle. Moreover, the water surface tension becomes considerably larger than the macroscopic bulk value due to combined effects of thin-film confinement and tight curvature, in a way that strongly depends on humidity and particle size. Taking these effects into proper account, classical capillary equations can be used to predict the interparticle forces even of the smallest particles considered here (4 nm), although the circular approximation fails to reproduce the distance at which the water meniscus breaks. Finally, the transition between the dominating effects at the nanoscopic scale and conventional capillary theory valid at microscopic size scales can be only rationalized if the presence of roughness asperities on the surface of the large particles is explicitly taken into account."}],"publication":"The Journal of Physical Chemistry C","citation":{"bibtex":"@article{Laube_Dörmann_Schmid_Mädler_Colombi Ciacchi_2017, title={Dependencies of the Adhesion Forces between TiO2 Nanoparticles on Size and Ambient Humidity}, DOI={<a href=\"https://doi.org/10.1021/acs.jpcc.7b05655\">10.1021/acs.jpcc.7b05655</a>}, journal={The Journal of Physical Chemistry C}, author={Laube, Jens and Dörmann, Michael and Schmid, Hans-Joachim and Mädler, Lutz and Colombi Ciacchi, Lucio}, year={2017}, pages={15294–15303} }","ama":"Laube J, Dörmann M, Schmid H-J, Mädler L, Colombi Ciacchi L. Dependencies of the Adhesion Forces between TiO2 Nanoparticles on Size and Ambient Humidity. <i>The Journal of Physical Chemistry C</i>. Published online 2017:15294-15303. doi:<a href=\"https://doi.org/10.1021/acs.jpcc.7b05655\">10.1021/acs.jpcc.7b05655</a>","mla":"Laube, Jens, et al. “Dependencies of the Adhesion Forces between TiO2 Nanoparticles on Size and Ambient Humidity.” <i>The Journal of Physical Chemistry C</i>, 2017, pp. 15294–303, doi:<a href=\"https://doi.org/10.1021/acs.jpcc.7b05655\">10.1021/acs.jpcc.7b05655</a>.","short":"J. Laube, M. Dörmann, H.-J. Schmid, L. Mädler, L. Colombi Ciacchi, The Journal of Physical Chemistry C (2017) 15294–15303.","chicago":"Laube, Jens, Michael Dörmann, Hans-Joachim Schmid, Lutz Mädler, and Lucio Colombi Ciacchi. “Dependencies of the Adhesion Forces between TiO2 Nanoparticles on Size and Ambient Humidity.” <i>The Journal of Physical Chemistry C</i>, 2017, 15294–303. <a href=\"https://doi.org/10.1021/acs.jpcc.7b05655\">https://doi.org/10.1021/acs.jpcc.7b05655</a>.","ieee":"J. Laube, M. Dörmann, H.-J. Schmid, L. Mädler, and L. Colombi Ciacchi, “Dependencies of the Adhesion Forces between TiO2 Nanoparticles on Size and Ambient Humidity,” <i>The Journal of Physical Chemistry C</i>, pp. 15294–15303, 2017, doi: <a href=\"https://doi.org/10.1021/acs.jpcc.7b05655\">10.1021/acs.jpcc.7b05655</a>.","apa":"Laube, J., Dörmann, M., Schmid, H.-J., Mädler, L., &#38; Colombi Ciacchi, L. (2017). Dependencies of the Adhesion Forces between TiO2 Nanoparticles on Size and Ambient Humidity. <i>The Journal of Physical Chemistry C</i>, 15294–15303. <a href=\"https://doi.org/10.1021/acs.jpcc.7b05655\">https://doi.org/10.1021/acs.jpcc.7b05655</a>"}},{"volume":121,"user_id":"16199","funded_apc":"1","_id":"13424","page":"2192-2200","status":"public","project":[{"name":"Computing Resources Provided by the Paderborn Center for Parallel Computing","_id":"52"}],"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. X-ray Spectroscopy of Thin Film Free-Base Corroles: A Combined Theoretical and Experimental Characterization. <i>The Journal of Physical Chemistry C</i>. 2017;121:2192-2200. doi:<a href=\"https://doi.org/10.1021/acs.jpcc.6b09935\">10.1021/acs.jpcc.6b09935</a>","bibtex":"@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={<a href=\"https://doi.org/10.1021/acs.jpcc.6b09935\">10.1021/acs.jpcc.6b09935</a>}, 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} }","mla":"Aldahhak, Hazem, 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>, vol. 121, 2017, pp. 2192–200, doi:<a href=\"https://doi.org/10.1021/acs.jpcc.6b09935\">10.1021/acs.jpcc.6b09935</a>."},"doi":"10.1021/acs.jpcc.6b09935","language":[{"iso":"eng"}],"intvolume":"       121","date_updated":"2025-12-05T10:09:30Z","publication_status":"published","author":[{"id":"26687","full_name":"Aldahhak, Hazem","last_name":"Aldahhak","first_name":"Hazem"},{"last_name":"Paszkiewicz","first_name":"M.","full_name":"Paszkiewicz, M."},{"last_name":"Allegretti","first_name":"F.","full_name":"Allegretti, F."},{"first_name":"D. A.","last_name":"Duncan","full_name":"Duncan, D. A."},{"first_name":"S.","last_name":"Tebi","full_name":"Tebi, S."},{"full_name":"Deimel, P. S.","last_name":"Deimel","first_name":"P. S."},{"last_name":"Casado Aguilar","first_name":"P.","full_name":"Casado Aguilar, P."},{"full_name":"Zhang, Y.-Q.","last_name":"Zhang","first_name":"Y.-Q."},{"full_name":"Papageorgiou, A. C.","first_name":"A. C.","last_name":"Papageorgiou"},{"first_name":"R.","last_name":"Koch","full_name":"Koch, R."},{"first_name":"J. V.","last_name":"Barth","full_name":"Barth, J. V."},{"full_name":"Schmidt, Wolf Gero","orcid":"0000-0002-2717-5076","last_name":"Schmidt","first_name":"Wolf Gero","id":"468"},{"full_name":"Müllegger, S.","first_name":"S.","last_name":"Müllegger"},{"last_name":"Schöfberger","first_name":"W.","full_name":"Schöfberger, W."},{"full_name":"Klappenberger, F.","last_name":"Klappenberger","first_name":"F."},{"full_name":"Rauls, E.","first_name":"E.","last_name":"Rauls"},{"last_name":"Gerstmann","orcid":"0000-0002-4476-223X","first_name":"Uwe","full_name":"Gerstmann, Uwe","id":"171"}],"publication_identifier":{"issn":["1932-7447","1932-7455"]},"title":"X-ray Spectroscopy of Thin Film Free-Base Corroles: A Combined Theoretical and Experimental Characterization","year":"2017","department":[{"_id":"15"},{"_id":"170"},{"_id":"295"},{"_id":"790"},{"_id":"35"},{"_id":"230"},{"_id":"27"}],"type":"journal_article","date_created":"2019-09-20T12:14:02Z","publication":"The Journal of Physical Chemistry C"},{"extern":"1","citation":{"mla":"Ghorbani, Elaheh, et al. “Insights into Intrinsic Defects and the Incorporation of Na and K in the Cu2ZnSnSe4 Thin-Film Solar Cell Material from Hybrid-Functional Calculations.” <i>The Journal of Physical Chemistry C</i>, 2016, pp. 2064–69, doi:<a href=\"https://doi.org/10.1021/acs.jpcc.5b11022\">10.1021/acs.jpcc.5b11022</a>.","ama":"Ghorbani E, Kiss J, Mirhosseini H, et al. Insights into Intrinsic Defects and the Incorporation of Na and K in the Cu2ZnSnSe4 Thin-Film Solar Cell Material from Hybrid-Functional Calculations. <i>The Journal of Physical Chemistry C</i>. 2016:2064-2069. doi:<a href=\"https://doi.org/10.1021/acs.jpcc.5b11022\">10.1021/acs.jpcc.5b11022</a>","bibtex":"@article{Ghorbani_Kiss_Mirhosseini_Schmidt_Windeln_Kühne_Felser_2016, title={Insights into Intrinsic Defects and the Incorporation of Na and K in the Cu2ZnSnSe4 Thin-Film Solar Cell Material from Hybrid-Functional Calculations}, DOI={<a href=\"https://doi.org/10.1021/acs.jpcc.5b11022\">10.1021/acs.jpcc.5b11022</a>}, journal={The Journal of Physical Chemistry C}, author={Ghorbani, Elaheh and Kiss, Janos and Mirhosseini, Hossein and Schmidt, Markus and Windeln, Johannes and Kühne, Thomas and Felser, Claudia}, year={2016}, pages={2064–2069} }","apa":"Ghorbani, E., Kiss, J., Mirhosseini, H., Schmidt, M., Windeln, J., Kühne, T., &#38; Felser, C. (2016). Insights into Intrinsic Defects and the Incorporation of Na and K in the Cu2ZnSnSe4 Thin-Film Solar Cell Material from Hybrid-Functional Calculations. <i>The Journal of Physical Chemistry C</i>, 2064–2069. <a href=\"https://doi.org/10.1021/acs.jpcc.5b11022\">https://doi.org/10.1021/acs.jpcc.5b11022</a>","ieee":"E. Ghorbani <i>et al.</i>, “Insights into Intrinsic Defects and the Incorporation of Na and K in the Cu2ZnSnSe4 Thin-Film Solar Cell Material from Hybrid-Functional Calculations,” <i>The Journal of Physical Chemistry C</i>, pp. 2064–2069, 2016.","chicago":"Ghorbani, Elaheh, Janos Kiss, Hossein Mirhosseini, Markus Schmidt, Johannes Windeln, Thomas Kühne, and Claudia Felser. “Insights into Intrinsic Defects and the Incorporation of Na and K in the Cu2ZnSnSe4 Thin-Film Solar Cell Material from Hybrid-Functional Calculations.” <i>The Journal of Physical Chemistry C</i>, 2016, 2064–69. <a href=\"https://doi.org/10.1021/acs.jpcc.5b11022\">https://doi.org/10.1021/acs.jpcc.5b11022</a>.","short":"E. Ghorbani, J. Kiss, H. Mirhosseini, M. Schmidt, J. Windeln, T. Kühne, C. Felser, The Journal of Physical Chemistry C (2016) 2064–2069."},"publication":"The Journal of Physical Chemistry C","type":"journal_article","date_created":"2020-01-30T13:10:14Z","article_type":"original","publication_status":"published","date_updated":"2022-01-06T06:52:32Z","author":[{"first_name":"Elaheh","last_name":"Ghorbani","full_name":"Ghorbani, Elaheh"},{"first_name":"Janos","last_name":"Kiss","full_name":"Kiss, Janos"},{"id":"71051","first_name":"Hossein","orcid":"https://orcid.org/0000-0001-6179-1545","last_name":"Mirhosseini","full_name":"Mirhosseini, Hossein"},{"full_name":"Schmidt, Markus","first_name":"Markus","last_name":"Schmidt"},{"first_name":"Johannes","last_name":"Windeln","full_name":"Windeln, Johannes"},{"id":"49079","full_name":"Kühne, Thomas","last_name":"Kühne","first_name":"Thomas"},{"full_name":"Felser, Claudia","last_name":"Felser","first_name":"Claudia"}],"publication_identifier":{"issn":["1932-7447","1932-7455"]},"title":"Insights into Intrinsic Defects and the Incorporation of Na and K in the Cu2ZnSnSe4 Thin-Film Solar Cell Material from Hybrid-Functional Calculations","status":"public","year":"2016","user_id":"71692","doi":"10.1021/acs.jpcc.5b11022","_id":"15734","language":[{"iso":"eng"}],"page":"2064-2069"},{"year":"2016","status":"public","title":"Inhomogeneous and Homogeneous Line Broadening of Optical Spectra of PTCDA Molecules Adsorbed at Step Edges of Alkali Halide Surfaces","author":[{"full_name":"Paulheim, A.","last_name":"Paulheim","first_name":"A."},{"full_name":"Marquardt, C.","last_name":"Marquardt","first_name":"C."},{"first_name":"Hazem","last_name":"Aldahhak","full_name":"Aldahhak, Hazem"},{"last_name":"Rauls","first_name":"E.","full_name":"Rauls, E."},{"orcid":"0000-0002-2717-5076","first_name":"Wolf Gero","last_name":"Schmidt","full_name":"Schmidt, Wolf Gero","id":"468"},{"first_name":"M.","last_name":"Sokolowski","full_name":"Sokolowski, M."}],"publication_identifier":{"issn":["1932-7447","1932-7455"]},"date_updated":"2025-12-05T10:24:01Z","publication_status":"published","intvolume":"        10","page":"11926-11937","language":[{"iso":"eng"}],"_id":"13480","doi":"10.1021/acs.jpcc.6b01956","user_id":"16199","volume":10,"publication":"The Journal of Physical Chemistry C","citation":{"apa":"Paulheim, A., Marquardt, C., Aldahhak, H., Rauls, E., Schmidt, W. G., &#38; Sokolowski, M. (2016). Inhomogeneous and Homogeneous Line Broadening of Optical Spectra of PTCDA Molecules Adsorbed at Step Edges of Alkali Halide Surfaces. <i>The Journal of Physical Chemistry C</i>, <i>10</i>, 11926–11937. <a href=\"https://doi.org/10.1021/acs.jpcc.6b01956\">https://doi.org/10.1021/acs.jpcc.6b01956</a>","mla":"Paulheim, A., et al. “Inhomogeneous and Homogeneous Line Broadening of Optical Spectra of PTCDA Molecules Adsorbed at Step Edges of Alkali Halide Surfaces.” <i>The Journal of Physical Chemistry C</i>, vol. 10, 2016, pp. 11926–37, doi:<a href=\"https://doi.org/10.1021/acs.jpcc.6b01956\">10.1021/acs.jpcc.6b01956</a>.","ieee":"A. Paulheim, C. Marquardt, H. Aldahhak, E. Rauls, W. G. Schmidt, and M. Sokolowski, “Inhomogeneous and Homogeneous Line Broadening of Optical Spectra of PTCDA Molecules Adsorbed at Step Edges of Alkali Halide Surfaces,” <i>The Journal of Physical Chemistry C</i>, vol. 10, pp. 11926–11937, 2016, doi: <a href=\"https://doi.org/10.1021/acs.jpcc.6b01956\">10.1021/acs.jpcc.6b01956</a>.","chicago":"Paulheim, A., C. Marquardt, Hazem Aldahhak, E. Rauls, Wolf Gero Schmidt, and M. Sokolowski. “Inhomogeneous and Homogeneous Line Broadening of Optical Spectra of PTCDA Molecules Adsorbed at Step Edges of Alkali Halide Surfaces.” <i>The Journal of Physical Chemistry C</i> 10 (2016): 11926–37. <a href=\"https://doi.org/10.1021/acs.jpcc.6b01956\">https://doi.org/10.1021/acs.jpcc.6b01956</a>.","short":"A. Paulheim, C. Marquardt, H. Aldahhak, E. Rauls, W.G. Schmidt, M. Sokolowski, The Journal of Physical Chemistry C 10 (2016) 11926–11937.","ama":"Paulheim A, Marquardt C, Aldahhak H, Rauls E, Schmidt WG, Sokolowski M. Inhomogeneous and Homogeneous Line Broadening of Optical Spectra of PTCDA Molecules Adsorbed at Step Edges of Alkali Halide Surfaces. <i>The Journal of Physical Chemistry C</i>. 2016;10:11926-11937. doi:<a href=\"https://doi.org/10.1021/acs.jpcc.6b01956\">10.1021/acs.jpcc.6b01956</a>","bibtex":"@article{Paulheim_Marquardt_Aldahhak_Rauls_Schmidt_Sokolowski_2016, title={Inhomogeneous and Homogeneous Line Broadening of Optical Spectra of PTCDA Molecules Adsorbed at Step Edges of Alkali Halide Surfaces}, volume={10}, DOI={<a href=\"https://doi.org/10.1021/acs.jpcc.6b01956\">10.1021/acs.jpcc.6b01956</a>}, journal={The Journal of Physical Chemistry C}, author={Paulheim, A. and Marquardt, C. and Aldahhak, Hazem and Rauls, E. and Schmidt, Wolf Gero and Sokolowski, M.}, year={2016}, pages={11926–11937} }"},"project":[{"_id":"52","name":"Computing Resources Provided by the Paderborn Center for Parallel Computing"}],"date_created":"2019-09-30T11:48:22Z","type":"journal_article","department":[{"_id":"15"},{"_id":"170"},{"_id":"295"},{"_id":"35"},{"_id":"230"},{"_id":"27"}]},{"publication":"The Journal of Physical Chemistry C","citation":{"chicago":"Vollbrecht, Joachim, Christian Wiebeler, Adam Neuba, Harald Bock, Stefan Schumacher, and Heinz-Siegfried Kitzerow. “Bay-Extended, Distorted Perylene Esters Showing Visible Luminescence after Ultraviolet Excitation: Photophysical and Electrochemical Analysis.” <i>The Journal of Physical Chemistry C</i>, 2016, 7839–48. <a href=\"https://doi.org/10.1021/acs.jpcc.6b00954\">https://doi.org/10.1021/acs.jpcc.6b00954</a>.","short":"J. Vollbrecht, C. Wiebeler, A. Neuba, H. Bock, S. Schumacher, H.-S. Kitzerow, The Journal of Physical Chemistry C (2016) 7839–7848.","apa":"Vollbrecht, J., Wiebeler, C., Neuba, A., Bock, H., Schumacher, S., &#38; Kitzerow, H.-S. (2016). Bay-Extended, Distorted Perylene Esters Showing Visible Luminescence after Ultraviolet Excitation: Photophysical and Electrochemical Analysis. <i>The Journal of Physical Chemistry C</i>, 7839–7848. <a href=\"https://doi.org/10.1021/acs.jpcc.6b00954\">https://doi.org/10.1021/acs.jpcc.6b00954</a>","ieee":"J. Vollbrecht, C. Wiebeler, A. Neuba, H. Bock, S. Schumacher, and H.-S. Kitzerow, “Bay-Extended, Distorted Perylene Esters Showing Visible Luminescence after Ultraviolet Excitation: Photophysical and Electrochemical Analysis,” <i>The Journal of Physical Chemistry C</i>, pp. 7839–7848, 2016, doi: <a href=\"https://doi.org/10.1021/acs.jpcc.6b00954\">10.1021/acs.jpcc.6b00954</a>.","ama":"Vollbrecht J, Wiebeler C, Neuba A, Bock H, Schumacher S, Kitzerow H-S. Bay-Extended, Distorted Perylene Esters Showing Visible Luminescence after Ultraviolet Excitation: Photophysical and Electrochemical Analysis. <i>The Journal of Physical Chemistry C</i>. Published online 2016:7839-7848. doi:<a href=\"https://doi.org/10.1021/acs.jpcc.6b00954\">10.1021/acs.jpcc.6b00954</a>","bibtex":"@article{Vollbrecht_Wiebeler_Neuba_Bock_Schumacher_Kitzerow_2016, title={Bay-Extended, Distorted Perylene Esters Showing Visible Luminescence after Ultraviolet Excitation: Photophysical and Electrochemical Analysis}, DOI={<a href=\"https://doi.org/10.1021/acs.jpcc.6b00954\">10.1021/acs.jpcc.6b00954</a>}, journal={The Journal of Physical Chemistry C}, author={Vollbrecht, Joachim and Wiebeler, Christian and Neuba, Adam and Bock, Harald and Schumacher, Stefan and Kitzerow, Heinz-Siegfried}, year={2016}, pages={7839–7848} }","mla":"Vollbrecht, Joachim, et al. “Bay-Extended, Distorted Perylene Esters Showing Visible Luminescence after Ultraviolet Excitation: Photophysical and Electrochemical Analysis.” <i>The Journal of Physical Chemistry C</i>, 2016, pp. 7839–48, doi:<a href=\"https://doi.org/10.1021/acs.jpcc.6b00954\">10.1021/acs.jpcc.6b00954</a>."},"project":[{"name":"Computing Resources Provided by the Paderborn Center for Parallel Computing","_id":"52"}],"date_created":"2020-02-10T11:44:30Z","type":"journal_article","department":[{"_id":"15"},{"_id":"170"},{"_id":"297"},{"_id":"313"},{"_id":"230"},{"_id":"35"},{"_id":"230"},{"_id":"27"}],"status":"public","year":"2016","title":"Bay-Extended, Distorted Perylene Esters Showing Visible Luminescence after Ultraviolet Excitation: Photophysical and Electrochemical Analysis","author":[{"full_name":"Vollbrecht, Joachim","last_name":"Vollbrecht","first_name":"Joachim"},{"first_name":"Christian","last_name":"Wiebeler","full_name":"Wiebeler, Christian"},{"first_name":"Adam","last_name":"Neuba","full_name":"Neuba, Adam"},{"first_name":"Harald","last_name":"Bock","full_name":"Bock, Harald"},{"first_name":"Stefan","orcid":"0000-0003-4042-4951","last_name":"Schumacher","full_name":"Schumacher, Stefan","id":"27271"},{"full_name":"Kitzerow, Heinz-Siegfried","last_name":"Kitzerow","first_name":"Heinz-Siegfried","id":"254"}],"publication_identifier":{"issn":["1932-7447","1932-7455"]},"date_updated":"2025-12-05T14:42:35Z","publication_status":"published","page":"7839-7848","language":[{"iso":"eng"}],"_id":"15856","doi":"10.1021/acs.jpcc.6b00954","user_id":"16199"},{"language":[{"iso":"eng"}],"_id":"23634","page":"17648-17654","volume":119,"doi":"10.1021/acs.jpcc.5b03554","user_id":"84268","publication_identifier":{"issn":["1932-7447","1932-7455"]},"author":[{"last_name":"Haddad","first_name":"Julia","full_name":"Haddad, Julia"},{"full_name":"Steinrück, Hans-Georg","orcid":"0000-0001-6373-0877","first_name":"Hans-Georg","last_name":"Steinrück","id":"84268"},{"last_name":"Hlaing","first_name":"Htay","full_name":"Hlaing, Htay"},{"full_name":"Kewalramani, Sumit","last_name":"Kewalramani","first_name":"Sumit"},{"last_name":"Pontoni","first_name":"Diego","full_name":"Pontoni, Diego"},{"full_name":"Reichert, Harald","last_name":"Reichert","first_name":"Harald"},{"first_name":"Bridget M.","last_name":"Murphy","full_name":"Murphy, Bridget M."},{"full_name":"Festersen, Sven","last_name":"Festersen","first_name":"Sven"},{"full_name":"Runge, Benjamin","first_name":"Benjamin","last_name":"Runge"},{"last_name":"Magnussen","first_name":"Olaf M.","full_name":"Magnussen, Olaf M."},{"full_name":"Magerl, Andreas","last_name":"Magerl","first_name":"Andreas"},{"full_name":"Deutsch, Moshe","last_name":"Deutsch","first_name":"Moshe"},{"full_name":"Ocko, Benjamin M.","last_name":"Ocko","first_name":"Benjamin M."}],"year":"2015","status":"public","title":"Order and Melting in Self-Assembled Alkanol Monolayers on Amorphous SiO2","intvolume":"       119","date_updated":"2022-01-06T06:55:57Z","publication_status":"published","date_created":"2021-09-01T09:48:28Z","department":[{"_id":"633"}],"type":"journal_article","citation":{"bibtex":"@article{Haddad_Steinrück_Hlaing_Kewalramani_Pontoni_Reichert_Murphy_Festersen_Runge_Magnussen_et al._2015, title={Order and Melting in Self-Assembled Alkanol Monolayers on Amorphous SiO2}, volume={119}, DOI={<a href=\"https://doi.org/10.1021/acs.jpcc.5b03554\">10.1021/acs.jpcc.5b03554</a>}, journal={The Journal of Physical Chemistry C}, author={Haddad, Julia and Steinrück, Hans-Georg and Hlaing, Htay and Kewalramani, Sumit and Pontoni, Diego and Reichert, Harald and Murphy, Bridget M. and Festersen, Sven and Runge, Benjamin and Magnussen, Olaf M. and et al.}, year={2015}, pages={17648–17654} }","ama":"Haddad J, Steinrück H-G, Hlaing H, et al. Order and Melting in Self-Assembled Alkanol Monolayers on Amorphous SiO2. <i>The Journal of Physical Chemistry C</i>. 2015;119:17648-17654. doi:<a href=\"https://doi.org/10.1021/acs.jpcc.5b03554\">10.1021/acs.jpcc.5b03554</a>","mla":"Haddad, Julia, et al. “Order and Melting in Self-Assembled Alkanol Monolayers on Amorphous SiO2.” <i>The Journal of Physical Chemistry C</i>, vol. 119, 2015, pp. 17648–54, doi:<a href=\"https://doi.org/10.1021/acs.jpcc.5b03554\">10.1021/acs.jpcc.5b03554</a>.","chicago":"Haddad, Julia, Hans-Georg Steinrück, Htay Hlaing, Sumit Kewalramani, Diego Pontoni, Harald Reichert, Bridget M. Murphy, et al. “Order and Melting in Self-Assembled Alkanol Monolayers on Amorphous SiO2.” <i>The Journal of Physical Chemistry C</i> 119 (2015): 17648–54. <a href=\"https://doi.org/10.1021/acs.jpcc.5b03554\">https://doi.org/10.1021/acs.jpcc.5b03554</a>.","short":"J. Haddad, H.-G. Steinrück, H. Hlaing, S. Kewalramani, D. Pontoni, H. Reichert, B.M. Murphy, S. Festersen, B. Runge, O.M. Magnussen, A. Magerl, M. Deutsch, B.M. Ocko, The Journal of Physical Chemistry C 119 (2015) 17648–17654.","ieee":"J. Haddad <i>et al.</i>, “Order and Melting in Self-Assembled Alkanol Monolayers on Amorphous SiO2,” <i>The Journal of Physical Chemistry C</i>, vol. 119, pp. 17648–17654, 2015, doi: <a href=\"https://doi.org/10.1021/acs.jpcc.5b03554\">10.1021/acs.jpcc.5b03554</a>.","apa":"Haddad, J., Steinrück, H.-G., Hlaing, H., Kewalramani, S., Pontoni, D., Reichert, H., Murphy, B. M., Festersen, S., Runge, B., Magnussen, O. M., Magerl, A., Deutsch, M., &#38; Ocko, B. M. (2015). Order and Melting in Self-Assembled Alkanol Monolayers on Amorphous SiO2. <i>The Journal of Physical Chemistry C</i>, <i>119</i>, 17648–17654. <a href=\"https://doi.org/10.1021/acs.jpcc.5b03554\">https://doi.org/10.1021/acs.jpcc.5b03554</a>"},"publication":"The Journal of Physical Chemistry C"},{"type":"journal_article","date_created":"2020-01-30T13:10:45Z","extern":"1","citation":{"mla":"Ghorbani, Elaheh, et al. “Hybrid-Functional Calculations on the Incorporation of Na and K Impurities into the CuInSe2 and CuIn5Se8 Solar-Cell Materials.” <i>The Journal of Physical Chemistry C</i>, 2015, pp. 25197–203, doi:<a href=\"https://doi.org/10.1021/acs.jpcc.5b07639\">10.1021/acs.jpcc.5b07639</a>.","bibtex":"@article{Ghorbani_Kiss_Mirhosseini_Roma_Schmidt_Windeln_Kühne_Felser_2015, title={Hybrid-Functional Calculations on the Incorporation of Na and K Impurities into the CuInSe2 and CuIn5Se8 Solar-Cell Materials}, DOI={<a href=\"https://doi.org/10.1021/acs.jpcc.5b07639\">10.1021/acs.jpcc.5b07639</a>}, journal={The Journal of Physical Chemistry C}, author={Ghorbani, Elaheh and Kiss, Janos and Mirhosseini, Hossein and Roma, Guido and Schmidt, Markus and Windeln, Johannes and Kühne, Thomas and Felser, Claudia}, year={2015}, pages={25197–25203} }","ama":"Ghorbani E, Kiss J, Mirhosseini H, et al. Hybrid-Functional Calculations on the Incorporation of Na and K Impurities into the CuInSe2 and CuIn5Se8 Solar-Cell Materials. <i>The Journal of Physical Chemistry C</i>. 2015:25197-25203. doi:<a href=\"https://doi.org/10.1021/acs.jpcc.5b07639\">10.1021/acs.jpcc.5b07639</a>","ieee":"E. Ghorbani <i>et al.</i>, “Hybrid-Functional Calculations on the Incorporation of Na and K Impurities into the CuInSe2 and CuIn5Se8 Solar-Cell Materials,” <i>The Journal of Physical Chemistry C</i>, pp. 25197–25203, 2015.","apa":"Ghorbani, E., Kiss, J., Mirhosseini, H., Roma, G., Schmidt, M., Windeln, J., … Felser, C. (2015). Hybrid-Functional Calculations on the Incorporation of Na and K Impurities into the CuInSe2 and CuIn5Se8 Solar-Cell Materials. <i>The Journal of Physical Chemistry C</i>, 25197–25203. <a href=\"https://doi.org/10.1021/acs.jpcc.5b07639\">https://doi.org/10.1021/acs.jpcc.5b07639</a>","chicago":"Ghorbani, Elaheh, Janos Kiss, Hossein Mirhosseini, Guido Roma, Markus Schmidt, Johannes Windeln, Thomas Kühne, and Claudia Felser. “Hybrid-Functional Calculations on the Incorporation of Na and K Impurities into the CuInSe2 and CuIn5Se8 Solar-Cell Materials.” <i>The Journal of Physical Chemistry C</i>, 2015, 25197–203. <a href=\"https://doi.org/10.1021/acs.jpcc.5b07639\">https://doi.org/10.1021/acs.jpcc.5b07639</a>.","short":"E. Ghorbani, J. Kiss, H. Mirhosseini, G. Roma, M. Schmidt, J. Windeln, T. Kühne, C. Felser, The Journal of Physical Chemistry C (2015) 25197–25203."},"publication":"The Journal of Physical Chemistry C","doi":"10.1021/acs.jpcc.5b07639","user_id":"71692","_id":"15736","language":[{"iso":"eng"}],"page":"25197-25203","article_type":"original","date_updated":"2022-01-06T06:52:32Z","publication_status":"published","publication_identifier":{"issn":["1932-7447","1932-7455"]},"author":[{"full_name":"Ghorbani, Elaheh","last_name":"Ghorbani","first_name":"Elaheh"},{"full_name":"Kiss, Janos","last_name":"Kiss","first_name":"Janos"},{"first_name":"Hossein","orcid":"https://orcid.org/0000-0001-6179-1545","last_name":"Mirhosseini","full_name":"Mirhosseini, Hossein","id":"71051"},{"first_name":"Guido","last_name":"Roma","full_name":"Roma, Guido"},{"last_name":"Schmidt","first_name":"Markus","full_name":"Schmidt, Markus"},{"full_name":"Windeln, Johannes","last_name":"Windeln","first_name":"Johannes"},{"id":"49079","full_name":"Kühne, Thomas","last_name":"Kühne","first_name":"Thomas"},{"full_name":"Felser, Claudia","last_name":"Felser","first_name":"Claudia"}],"title":"Hybrid-Functional Calculations on the Incorporation of Na and K Impurities into the CuInSe2 and CuIn5Se8 Solar-Cell Materials","status":"public","year":"2015"},{"publication":"The Journal of Physical Chemistry C","citation":{"short":"C. Braun, S. Sanna, W.G. Schmidt, The Journal of Physical Chemistry C (2015) 9342–9346.","chicago":"Braun, Christian, Simone Sanna, and Wolf Gero Schmidt. “Liquid Crystal (8CB) Molecular Adsorption on Lithium Niobate Z-Cut Surfaces.” <i>The Journal of Physical Chemistry C</i>, 2015, 9342–46. <a href=\"https://doi.org/10.1021/acs.jpcc.5b00894\">https://doi.org/10.1021/acs.jpcc.5b00894</a>.","apa":"Braun, C., Sanna, S., &#38; Schmidt, W. G. (2015). Liquid Crystal (8CB) Molecular Adsorption on Lithium Niobate Z-Cut Surfaces. <i>The Journal of Physical Chemistry C</i>, 9342–9346. <a href=\"https://doi.org/10.1021/acs.jpcc.5b00894\">https://doi.org/10.1021/acs.jpcc.5b00894</a>","ieee":"C. Braun, S. Sanna, and W. G. Schmidt, “Liquid Crystal (8CB) Molecular Adsorption on Lithium Niobate Z-Cut Surfaces,” <i>The Journal of Physical Chemistry C</i>, pp. 9342–9346, 2015.","ama":"Braun C, Sanna S, Schmidt WG. Liquid Crystal (8CB) Molecular Adsorption on Lithium Niobate Z-Cut Surfaces. <i>The Journal of Physical Chemistry C</i>. 2015:9342-9346. doi:<a href=\"https://doi.org/10.1021/acs.jpcc.5b00894\">10.1021/acs.jpcc.5b00894</a>","bibtex":"@article{Braun_Sanna_Schmidt_2015, title={Liquid Crystal (8CB) Molecular Adsorption on Lithium Niobate Z-Cut Surfaces}, DOI={<a href=\"https://doi.org/10.1021/acs.jpcc.5b00894\">10.1021/acs.jpcc.5b00894</a>}, journal={The Journal of Physical Chemistry C}, author={Braun, Christian and Sanna, Simone and Schmidt, Wolf Gero}, year={2015}, pages={9342–9346} }","mla":"Braun, Christian, et al. “Liquid Crystal (8CB) Molecular Adsorption on Lithium Niobate Z-Cut Surfaces.” <i>The Journal of Physical Chemistry C</i>, 2015, pp. 9342–46, doi:<a href=\"https://doi.org/10.1021/acs.jpcc.5b00894\">10.1021/acs.jpcc.5b00894</a>."},"project":[{"name":"Computing Resources Provided by the Paderborn Center for Parallel Computing","_id":"52"},{"name":"TRR 142","_id":"53"},{"_id":"55","name":"TRR 142 - Project Area B"},{"name":"TRR 142 - Subproject B4","_id":"69"}],"date_created":"2019-05-29T08:37:53Z","type":"journal_article","department":[{"_id":"15"}],"year":"2015","title":"Liquid Crystal (8CB) Molecular Adsorption on Lithium Niobate Z-Cut Surfaces","status":"public","publication_identifier":{"issn":["1932-7447","1932-7455"]},"author":[{"last_name":"Braun","orcid":"0000-0002-3224-2683","first_name":"Christian","full_name":"Braun, Christian","id":"28675"},{"full_name":"Sanna, Simone","first_name":"Simone","last_name":"Sanna"},{"last_name":"Schmidt","orcid":"0000-0002-2717-5076","first_name":"Wolf Gero","full_name":"Schmidt, Wolf Gero","id":"468"}],"date_updated":"2022-01-06T06:50:26Z","publication_status":"published","page":"9342-9346","language":[{"iso":"eng"}],"_id":"10029","funded_apc":"1","doi":"10.1021/acs.jpcc.5b00894","user_id":"16199"},{"doi":"10.1021/acs.jpcc.5b03816","user_id":"16199","volume":119,"page":"16947-16953","language":[{"iso":"eng"}],"_id":"13499","date_updated":"2025-12-05T10:39:10Z","publication_status":"published","intvolume":"       119","year":"2015","title":"Nanopatterning on H-Terminated Si(111) Explained as Dynamic Equilibrium of the Chemical Reaction with Methanol","status":"public","author":[{"last_name":"Thissen","first_name":"Peter","full_name":"Thissen, Peter"},{"first_name":"Ehud","last_name":"Fuchs","full_name":"Fuchs, Ehud"},{"full_name":"Roodenko, Katy","last_name":"Roodenko","first_name":"Katy"},{"full_name":"Peixoto, Tatiana","last_name":"Peixoto","first_name":"Tatiana"},{"full_name":"Batchelor, Ben","first_name":"Ben","last_name":"Batchelor"},{"full_name":"Smith, Dennis","last_name":"Smith","first_name":"Dennis"},{"last_name":"Schmidt","orcid":"0000-0002-2717-5076","first_name":"Wolf Gero","full_name":"Schmidt, Wolf Gero","id":"468"},{"last_name":"Chabal","first_name":"Yves","full_name":"Chabal, Yves"}],"publication_identifier":{"issn":["1932-7447","1932-7455"]},"type":"journal_article","department":[{"_id":"15"},{"_id":"170"},{"_id":"295"},{"_id":"35"},{"_id":"230"}],"date_created":"2019-09-30T12:50:03Z","publication":"The Journal of Physical Chemistry C","citation":{"apa":"Thissen, P., Fuchs, E., Roodenko, K., Peixoto, T., Batchelor, B., Smith, D., Schmidt, W. G., &#38; Chabal, Y. (2015). Nanopatterning on H-Terminated Si(111) Explained as Dynamic Equilibrium of the Chemical Reaction with Methanol. <i>The Journal of Physical Chemistry C</i>, <i>119</i>, 16947–16953. <a href=\"https://doi.org/10.1021/acs.jpcc.5b03816\">https://doi.org/10.1021/acs.jpcc.5b03816</a>","ieee":"P. Thissen <i>et al.</i>, “Nanopatterning on H-Terminated Si(111) Explained as Dynamic Equilibrium of the Chemical Reaction with Methanol,” <i>The Journal of Physical Chemistry C</i>, vol. 119, pp. 16947–16953, 2015, doi: <a href=\"https://doi.org/10.1021/acs.jpcc.5b03816\">10.1021/acs.jpcc.5b03816</a>.","short":"P. Thissen, E. Fuchs, K. Roodenko, T. Peixoto, B. Batchelor, D. Smith, W.G. Schmidt, Y. Chabal, The Journal of Physical Chemistry C 119 (2015) 16947–16953.","chicago":"Thissen, Peter, Ehud Fuchs, Katy Roodenko, Tatiana Peixoto, Ben Batchelor, Dennis Smith, Wolf Gero Schmidt, and Yves Chabal. “Nanopatterning on H-Terminated Si(111) Explained as Dynamic Equilibrium of the Chemical Reaction with Methanol.” <i>The Journal of Physical Chemistry C</i> 119 (2015): 16947–53. <a href=\"https://doi.org/10.1021/acs.jpcc.5b03816\">https://doi.org/10.1021/acs.jpcc.5b03816</a>.","mla":"Thissen, Peter, et al. “Nanopatterning on H-Terminated Si(111) Explained as Dynamic Equilibrium of the Chemical Reaction with Methanol.” <i>The Journal of Physical Chemistry C</i>, vol. 119, 2015, pp. 16947–53, doi:<a href=\"https://doi.org/10.1021/acs.jpcc.5b03816\">10.1021/acs.jpcc.5b03816</a>.","ama":"Thissen P, Fuchs E, Roodenko K, et al. Nanopatterning on H-Terminated Si(111) Explained as Dynamic Equilibrium of the Chemical Reaction with Methanol. <i>The Journal of Physical Chemistry C</i>. 2015;119:16947-16953. doi:<a href=\"https://doi.org/10.1021/acs.jpcc.5b03816\">10.1021/acs.jpcc.5b03816</a>","bibtex":"@article{Thissen_Fuchs_Roodenko_Peixoto_Batchelor_Smith_Schmidt_Chabal_2015, title={Nanopatterning on H-Terminated Si(111) Explained as Dynamic Equilibrium of the Chemical Reaction with Methanol}, volume={119}, DOI={<a href=\"https://doi.org/10.1021/acs.jpcc.5b03816\">10.1021/acs.jpcc.5b03816</a>}, journal={The Journal of Physical Chemistry C}, author={Thissen, Peter and Fuchs, Ehud and Roodenko, Katy and Peixoto, Tatiana and Batchelor, Ben and Smith, Dennis and Schmidt, Wolf Gero and Chabal, Yves}, year={2015}, pages={16947–16953} }"}},{"language":[{"iso":"eng"}],"_id":"15860","page":"9734-9744","doi":"10.1021/acs.jpcc.5b00680","user_id":"16199","author":[{"full_name":"Denis, Jean-Christophe","last_name":"Denis","first_name":"Jean-Christophe"},{"id":"27271","orcid":"0000-0003-4042-4951","first_name":"Stefan","last_name":"Schumacher","full_name":"Schumacher, Stefan"},{"full_name":"Hedley, Gordon J.","first_name":"Gordon J.","last_name":"Hedley"},{"last_name":"Ruseckas","first_name":"Arvydas","full_name":"Ruseckas, Arvydas"},{"last_name":"Morawska","first_name":"Paulina O.","full_name":"Morawska, Paulina O."},{"full_name":"Wang, Yue","first_name":"Yue","last_name":"Wang"},{"full_name":"Allard, Sybille","first_name":"Sybille","last_name":"Allard"},{"first_name":"Ullrich","last_name":"Scherf","full_name":"Scherf, Ullrich"},{"last_name":"Turnbull","first_name":"Graham A.","full_name":"Turnbull, Graham A."},{"first_name":"Ifor D. W.","last_name":"Samuel","full_name":"Samuel, Ifor D. W."},{"full_name":"Galbraith, Ian","first_name":"Ian","last_name":"Galbraith"}],"publication_identifier":{"issn":["1932-7447","1932-7455"]},"year":"2015","title":"Subpicosecond Exciton Dynamics in Polyfluorene Films from Experiment and Microscopic Theory","status":"public","date_updated":"2025-12-05T14:47:36Z","publication_status":"published","date_created":"2020-02-10T11:50:44Z","department":[{"_id":"15"},{"_id":"170"},{"_id":"297"},{"_id":"35"},{"_id":"230"},{"_id":"27"}],"type":"journal_article","citation":{"bibtex":"@article{Denis_Schumacher_Hedley_Ruseckas_Morawska_Wang_Allard_Scherf_Turnbull_Samuel_et al._2015, title={Subpicosecond Exciton Dynamics in Polyfluorene Films from Experiment and Microscopic Theory}, DOI={<a href=\"https://doi.org/10.1021/acs.jpcc.5b00680\">10.1021/acs.jpcc.5b00680</a>}, journal={The Journal of Physical Chemistry C}, author={Denis, Jean-Christophe and Schumacher, Stefan and Hedley, Gordon J. and Ruseckas, Arvydas and Morawska, Paulina O. and Wang, Yue and Allard, Sybille and Scherf, Ullrich and Turnbull, Graham A. and Samuel, Ifor D. W. and et al.}, year={2015}, pages={9734–9744} }","chicago":"Denis, Jean-Christophe, Stefan Schumacher, Gordon J. Hedley, Arvydas Ruseckas, Paulina O. Morawska, Yue Wang, Sybille Allard, et al. “Subpicosecond Exciton Dynamics in Polyfluorene Films from Experiment and Microscopic Theory.” <i>The Journal of Physical Chemistry C</i>, 2015, 9734–44. <a href=\"https://doi.org/10.1021/acs.jpcc.5b00680\">https://doi.org/10.1021/acs.jpcc.5b00680</a>.","ama":"Denis J-C, Schumacher S, Hedley GJ, et al. Subpicosecond Exciton Dynamics in Polyfluorene Films from Experiment and Microscopic Theory. <i>The Journal of Physical Chemistry C</i>. Published online 2015:9734-9744. doi:<a href=\"https://doi.org/10.1021/acs.jpcc.5b00680\">10.1021/acs.jpcc.5b00680</a>","short":"J.-C. Denis, S. Schumacher, G.J. Hedley, A. Ruseckas, P.O. Morawska, Y. Wang, S. Allard, U. Scherf, G.A. Turnbull, I.D.W. Samuel, I. Galbraith, The Journal of Physical Chemistry C (2015) 9734–9744.","ieee":"J.-C. Denis <i>et al.</i>, “Subpicosecond Exciton Dynamics in Polyfluorene Films from Experiment and Microscopic Theory,” <i>The Journal of Physical Chemistry C</i>, pp. 9734–9744, 2015, doi: <a href=\"https://doi.org/10.1021/acs.jpcc.5b00680\">10.1021/acs.jpcc.5b00680</a>.","mla":"Denis, Jean-Christophe, et al. “Subpicosecond Exciton Dynamics in Polyfluorene Films from Experiment and Microscopic Theory.” <i>The Journal of Physical Chemistry C</i>, 2015, pp. 9734–44, doi:<a href=\"https://doi.org/10.1021/acs.jpcc.5b00680\">10.1021/acs.jpcc.5b00680</a>.","apa":"Denis, J.-C., Schumacher, S., Hedley, G. J., Ruseckas, A., Morawska, P. O., Wang, Y., Allard, S., Scherf, U., Turnbull, G. A., Samuel, I. D. W., &#38; Galbraith, I. (2015). Subpicosecond Exciton Dynamics in Polyfluorene Films from Experiment and Microscopic Theory. <i>The Journal of Physical Chemistry C</i>, 9734–9744. <a href=\"https://doi.org/10.1021/acs.jpcc.5b00680\">https://doi.org/10.1021/acs.jpcc.5b00680</a>"},"publication":"The Journal of Physical Chemistry C","project":[{"_id":"52","name":"Computing Resources Provided by the Paderborn Center for Parallel Computing"}]},{"publication_identifier":{"issn":["1932-7447","1932-7455"]},"author":[{"full_name":"Hölscher, Rebecca","first_name":"Rebecca","last_name":"Hölscher"},{"id":"468","full_name":"Schmidt, Wolf Gero","last_name":"Schmidt","first_name":"Wolf Gero","orcid":"0000-0002-2717-5076"},{"last_name":"Sanna","first_name":"Simone","full_name":"Sanna, Simone"}],"title":"Modeling LiNbO3 Surfaces at Ambient Conditions","status":"public","year":"2014","date_updated":"2025-12-05T09:57:24Z","publication_status":"published","_id":"10036","funded_apc":"1","language":[{"iso":"eng"}],"page":"10213-10220","doi":"10.1021/jp502936f","user_id":"16199","citation":{"bibtex":"@article{Hölscher_Schmidt_Sanna_2014, title={Modeling LiNbO3 Surfaces at Ambient Conditions}, DOI={<a href=\"https://doi.org/10.1021/jp502936f\">10.1021/jp502936f</a>}, journal={The Journal of Physical Chemistry C}, author={Hölscher, Rebecca and Schmidt, Wolf Gero and Sanna, Simone}, year={2014}, pages={10213–10220} }","ama":"Hölscher R, Schmidt WG, Sanna S. Modeling LiNbO3 Surfaces at Ambient Conditions. <i>The Journal of Physical Chemistry C</i>. Published online 2014:10213-10220. doi:<a href=\"https://doi.org/10.1021/jp502936f\">10.1021/jp502936f</a>","mla":"Hölscher, Rebecca, et al. “Modeling LiNbO3 Surfaces at Ambient Conditions.” <i>The Journal of Physical Chemistry C</i>, 2014, pp. 10213–20, doi:<a href=\"https://doi.org/10.1021/jp502936f\">10.1021/jp502936f</a>.","chicago":"Hölscher, Rebecca, Wolf Gero Schmidt, and Simone Sanna. “Modeling LiNbO3 Surfaces at Ambient Conditions.” <i>The Journal of Physical Chemistry C</i>, 2014, 10213–20. <a href=\"https://doi.org/10.1021/jp502936f\">https://doi.org/10.1021/jp502936f</a>.","short":"R. Hölscher, W.G. Schmidt, S. Sanna, The Journal of Physical Chemistry C (2014) 10213–10220.","ieee":"R. Hölscher, W. G. Schmidt, and S. Sanna, “Modeling LiNbO3 Surfaces at Ambient Conditions,” <i>The Journal of Physical Chemistry C</i>, pp. 10213–10220, 2014, doi: <a href=\"https://doi.org/10.1021/jp502936f\">10.1021/jp502936f</a>.","apa":"Hölscher, R., Schmidt, W. G., &#38; Sanna, S. (2014). Modeling LiNbO3 Surfaces at Ambient Conditions. <i>The Journal of Physical Chemistry C</i>, 10213–10220. <a href=\"https://doi.org/10.1021/jp502936f\">https://doi.org/10.1021/jp502936f</a>"},"publication":"The Journal of Physical Chemistry C","project":[{"name":"Computing Resources Provided by the Paderborn Center for Parallel Computing","_id":"52"},{"name":"TRR 142","_id":"53"},{"_id":"55","name":"TRR 142 - Project Area B"},{"name":"TRR 142 - Subproject B4","_id":"69"},{"_id":"52","name":"Computing Resources Provided by the Paderborn Center for Parallel Computing"}],"date_created":"2019-05-29T08:56:42Z","department":[{"_id":"15"},{"_id":"170"},{"_id":"295"},{"_id":"35"},{"_id":"429"},{"_id":"27"}],"type":"journal_article"},{"title":"Formation of Hydroxyl Groups at Calcium-Silicate-Hydrate (C-S-H): Coexistence of Ca–OH and Si–OH on Wollastonite(001)","status":"public","year":"2014","publication_identifier":{"issn":["1932-7447","1932-7455"]},"author":[{"full_name":"Sanna, Simone","first_name":"Simone","last_name":"Sanna"},{"first_name":"Wolf Gero","last_name":"Schmidt","orcid":"0000-0002-2717-5076","full_name":"Schmidt, Wolf Gero","id":"468"},{"full_name":"Thissen, Peter","first_name":"Peter","last_name":"Thissen"}],"date_updated":"2025-12-05T10:33:35Z","publication_status":"published","intvolume":"       118","page":"8007-8013","_id":"13512","language":[{"iso":"eng"}],"doi":"10.1021/jp500170t","user_id":"16199","volume":118,"publication":"The Journal of Physical Chemistry C","citation":{"mla":"Sanna, Simone, et al. “Formation of Hydroxyl Groups at Calcium-Silicate-Hydrate (C-S-H): Coexistence of Ca–OH and Si–OH on Wollastonite(001).” <i>The Journal of Physical Chemistry C</i>, vol. 118, 2014, pp. 8007–13, doi:<a href=\"https://doi.org/10.1021/jp500170t\">10.1021/jp500170t</a>.","ama":"Sanna S, Schmidt WG, Thissen P. Formation of Hydroxyl Groups at Calcium-Silicate-Hydrate (C-S-H): Coexistence of Ca–OH and Si–OH on Wollastonite(001). <i>The Journal of Physical Chemistry C</i>. 2014;118:8007-8013. doi:<a href=\"https://doi.org/10.1021/jp500170t\">10.1021/jp500170t</a>","bibtex":"@article{Sanna_Schmidt_Thissen_2014, title={Formation of Hydroxyl Groups at Calcium-Silicate-Hydrate (C-S-H): Coexistence of Ca–OH and Si–OH on Wollastonite(001)}, volume={118}, DOI={<a href=\"https://doi.org/10.1021/jp500170t\">10.1021/jp500170t</a>}, journal={The Journal of Physical Chemistry C}, author={Sanna, Simone and Schmidt, Wolf Gero and Thissen, Peter}, year={2014}, pages={8007–8013} }","apa":"Sanna, S., Schmidt, W. G., &#38; Thissen, P. (2014). Formation of Hydroxyl Groups at Calcium-Silicate-Hydrate (C-S-H): Coexistence of Ca–OH and Si–OH on Wollastonite(001). <i>The Journal of Physical Chemistry C</i>, <i>118</i>, 8007–8013. <a href=\"https://doi.org/10.1021/jp500170t\">https://doi.org/10.1021/jp500170t</a>","ieee":"S. Sanna, W. G. Schmidt, and P. Thissen, “Formation of Hydroxyl Groups at Calcium-Silicate-Hydrate (C-S-H): Coexistence of Ca–OH and Si–OH on Wollastonite(001),” <i>The Journal of Physical Chemistry C</i>, vol. 118, pp. 8007–8013, 2014, doi: <a href=\"https://doi.org/10.1021/jp500170t\">10.1021/jp500170t</a>.","short":"S. Sanna, W.G. Schmidt, P. Thissen, The Journal of Physical Chemistry C 118 (2014) 8007–8013.","chicago":"Sanna, Simone, Wolf Gero Schmidt, and Peter Thissen. “Formation of Hydroxyl Groups at Calcium-Silicate-Hydrate (C-S-H): Coexistence of Ca–OH and Si–OH on Wollastonite(001).” <i>The Journal of Physical Chemistry C</i> 118 (2014): 8007–13. <a href=\"https://doi.org/10.1021/jp500170t\">https://doi.org/10.1021/jp500170t</a>."},"date_created":"2019-09-30T13:35:25Z","type":"journal_article","department":[{"_id":"15"},{"_id":"170"},{"_id":"295"},{"_id":"2"},{"_id":"35"},{"_id":"230"}]},{"date_created":"2019-09-30T13:26:17Z","type":"journal_article","department":[{"_id":"15"},{"_id":"170"},{"_id":"295"},{"_id":"35"},{"_id":"230"},{"_id":"27"}],"publication":"The Journal of Physical Chemistry C","citation":{"mla":"Guo, Q., et al. “Adsorption of PTCDA on Terraces and at Steps Sites of the KCl(100) Surface.” <i>The Journal of Physical Chemistry C</i>, vol. 118, 2014, pp. 29911–18, doi:<a href=\"https://doi.org/10.1021/jp509663s\">10.1021/jp509663s</a>.","apa":"Guo, Q., Paulheim, A., Sokolowski, M., Aldahhak, H., Rauls, E., &#38; Schmidt, W. G. (2014). Adsorption of PTCDA on Terraces and at Steps Sites of the KCl(100) Surface. <i>The Journal of Physical Chemistry C</i>, <i>118</i>, 29911–29918. <a href=\"https://doi.org/10.1021/jp509663s\">https://doi.org/10.1021/jp509663s</a>","ieee":"Q. Guo, A. Paulheim, M. Sokolowski, H. Aldahhak, E. Rauls, and W. G. Schmidt, “Adsorption of PTCDA on Terraces and at Steps Sites of the KCl(100) Surface,” <i>The Journal of Physical Chemistry C</i>, vol. 118, pp. 29911–29918, 2014, doi: <a href=\"https://doi.org/10.1021/jp509663s\">10.1021/jp509663s</a>.","ama":"Guo Q, Paulheim A, Sokolowski M, Aldahhak H, Rauls E, Schmidt WG. Adsorption of PTCDA on Terraces and at Steps Sites of the KCl(100) Surface. <i>The Journal of Physical Chemistry C</i>. 2014;118:29911-29918. doi:<a href=\"https://doi.org/10.1021/jp509663s\">10.1021/jp509663s</a>","short":"Q. Guo, A. Paulheim, M. Sokolowski, H. Aldahhak, E. Rauls, W.G. Schmidt, The Journal of Physical Chemistry C 118 (2014) 29911–29918.","chicago":"Guo, Q., A. Paulheim, M. Sokolowski, Hazem Aldahhak, E. Rauls, and Wolf Gero Schmidt. “Adsorption of PTCDA on Terraces and at Steps Sites of the KCl(100) Surface.” <i>The Journal of Physical Chemistry C</i> 118 (2014): 29911–18. <a href=\"https://doi.org/10.1021/jp509663s\">https://doi.org/10.1021/jp509663s</a>.","bibtex":"@article{Guo_Paulheim_Sokolowski_Aldahhak_Rauls_Schmidt_2014, title={Adsorption of PTCDA on Terraces and at Steps Sites of the KCl(100) Surface}, volume={118}, DOI={<a href=\"https://doi.org/10.1021/jp509663s\">10.1021/jp509663s</a>}, journal={The Journal of Physical Chemistry C}, author={Guo, Q. and Paulheim, A. and Sokolowski, M. and Aldahhak, Hazem and Rauls, E. and Schmidt, Wolf Gero}, year={2014}, pages={29911–29918} }"},"project":[{"name":"Computing Resources Provided by the Paderborn Center for Parallel Computing","_id":"52"}],"page":"29911-29918","_id":"13508","language":[{"iso":"eng"}],"doi":"10.1021/jp509663s","user_id":"16199","volume":118,"status":"public","title":"Adsorption of PTCDA on Terraces and at Steps Sites of the KCl(100) Surface","year":"2014","publication_identifier":{"issn":["1932-7447","1932-7455"]},"author":[{"first_name":"Q.","last_name":"Guo","full_name":"Guo, Q."},{"full_name":"Paulheim, A.","first_name":"A.","last_name":"Paulheim"},{"full_name":"Sokolowski, M.","first_name":"M.","last_name":"Sokolowski"},{"full_name":"Aldahhak, Hazem","first_name":"Hazem","last_name":"Aldahhak"},{"last_name":"Rauls","first_name":"E.","full_name":"Rauls, E."},{"orcid":"0000-0002-2717-5076","first_name":"Wolf Gero","last_name":"Schmidt","full_name":"Schmidt, Wolf Gero","id":"468"}],"date_updated":"2025-12-05T10:35:20Z","publication_status":"published","intvolume":"       118"},{"author":[{"full_name":"Haffer, Stefanie","last_name":"Haffer","first_name":"Stefanie"},{"full_name":"Walther, Till","first_name":"Till","last_name":"Walther"},{"full_name":"Köferstein, Roberto","first_name":"Roberto","last_name":"Köferstein"},{"full_name":"Ebbinghaus, Stefan G.","last_name":"Ebbinghaus","first_name":"Stefan G."},{"full_name":"Tiemann, Michael","last_name":"Tiemann","orcid":"0000-0003-1711-2722","first_name":"Michael","id":"23547"}],"publication_identifier":{"issn":["1932-7447","1932-7455"]},"status":"public","year":"2013","title":"Nanostructure-Related Magnetic Properties of Various Mesoporous Cobalt Oxide and Cobalt Ferrite Spinel Phases","article_type":"original","date_updated":"2023-03-08T10:34:31Z","publication_status":"published","language":[{"iso":"eng"}],"_id":"25953","page":"24471-24478","doi":"10.1021/jp409058t","user_id":"23547","citation":{"ama":"Haffer S, Walther T, Köferstein R, Ebbinghaus SG, Tiemann M. Nanostructure-Related Magnetic Properties of Various Mesoporous Cobalt Oxide and Cobalt Ferrite Spinel Phases. <i>The Journal of Physical Chemistry C</i>. Published online 2013:24471-24478. doi:<a href=\"https://doi.org/10.1021/jp409058t\">10.1021/jp409058t</a>","bibtex":"@article{Haffer_Walther_Köferstein_Ebbinghaus_Tiemann_2013, title={Nanostructure-Related Magnetic Properties of Various Mesoporous Cobalt Oxide and Cobalt Ferrite Spinel Phases}, DOI={<a href=\"https://doi.org/10.1021/jp409058t\">10.1021/jp409058t</a>}, journal={The Journal of Physical Chemistry C}, author={Haffer, Stefanie and Walther, Till and Köferstein, Roberto and Ebbinghaus, Stefan G. and Tiemann, Michael}, year={2013}, pages={24471–24478} }","mla":"Haffer, Stefanie, et al. “Nanostructure-Related Magnetic Properties of Various Mesoporous Cobalt Oxide and Cobalt Ferrite Spinel Phases.” <i>The Journal of Physical Chemistry C</i>, 2013, pp. 24471–78, doi:<a href=\"https://doi.org/10.1021/jp409058t\">10.1021/jp409058t</a>.","short":"S. Haffer, T. Walther, R. Köferstein, S.G. Ebbinghaus, M. Tiemann, The Journal of Physical Chemistry C (2013) 24471–24478.","chicago":"Haffer, Stefanie, Till Walther, Roberto Köferstein, Stefan G. Ebbinghaus, and Michael Tiemann. “Nanostructure-Related Magnetic Properties of Various Mesoporous Cobalt Oxide and Cobalt Ferrite Spinel Phases.” <i>The Journal of Physical Chemistry C</i>, 2013, 24471–78. <a href=\"https://doi.org/10.1021/jp409058t\">https://doi.org/10.1021/jp409058t</a>.","apa":"Haffer, S., Walther, T., Köferstein, R., Ebbinghaus, S. G., &#38; Tiemann, M. (2013). Nanostructure-Related Magnetic Properties of Various Mesoporous Cobalt Oxide and Cobalt Ferrite Spinel Phases. <i>The Journal of Physical Chemistry C</i>, 24471–24478. <a href=\"https://doi.org/10.1021/jp409058t\">https://doi.org/10.1021/jp409058t</a>","ieee":"S. Haffer, T. Walther, R. Köferstein, S. G. Ebbinghaus, and M. Tiemann, “Nanostructure-Related Magnetic Properties of Various Mesoporous Cobalt Oxide and Cobalt Ferrite Spinel Phases,” <i>The Journal of Physical Chemistry C</i>, pp. 24471–24478, 2013, doi: <a href=\"https://doi.org/10.1021/jp409058t\">10.1021/jp409058t</a>."},"publication":"The Journal of Physical Chemistry C","abstract":[{"lang":"eng","text":"Nanostructure-related magnetic properties are investigated systematically for various mesoporous cobalt oxide (Co3O4) and cobalt ferrite (CoFe2O4) spinel phases. Synthesis of the materials by nanocasting offers the opportunity to obtain materials which are different from each other with respect to both specific surface area and crystallite size. As a result, the respective contributions of two types of interfaces, namely, “solid–gas” and “solid–solid” interfaces, to the magnetic ordering can be distinguished. Structural characterization of the porous materials by X-ray diffraction, N2 physisorption, and electron microscopy as well as investigation of the magnetic behavior (field-dependent magnetization and temperature-dependent susceptibility) are presented."}],"quality_controlled":"1","date_created":"2021-10-09T04:42:49Z","department":[{"_id":"35"},{"_id":"2"},{"_id":"307"}],"type":"journal_article"},{"year":"2013","status":"public","title":"Excited-State Absorption of Conjugated Polymers in the Near-Infrared and Visible: A Computational Study of Oligofluorenes","author":[{"full_name":"Ling, Sanliang","first_name":"Sanliang","last_name":"Ling"},{"full_name":"Schumacher, Stefan","last_name":"Schumacher","orcid":"0000-0003-4042-4951","first_name":"Stefan","id":"27271"},{"first_name":"Ian","last_name":"Galbraith","full_name":"Galbraith, Ian"},{"full_name":"Paterson, Martin J.","first_name":"Martin J.","last_name":"Paterson"}],"publication_identifier":{"issn":["1932-7447","1932-7455"]},"date_updated":"2025-12-05T14:54:35Z","publication_status":"published","page":"6889-6895","language":[{"iso":"eng"}],"_id":"15870","doi":"10.1021/jp401359a","user_id":"16199","publication":"The Journal of Physical Chemistry C","citation":{"bibtex":"@article{Ling_Schumacher_Galbraith_Paterson_2013, title={Excited-State Absorption of Conjugated Polymers in the Near-Infrared and Visible: A Computational Study of Oligofluorenes}, DOI={<a href=\"https://doi.org/10.1021/jp401359a\">10.1021/jp401359a</a>}, journal={The Journal of Physical Chemistry C}, author={Ling, Sanliang and Schumacher, Stefan and Galbraith, Ian and Paterson, Martin J.}, year={2013}, pages={6889–6895} }","ama":"Ling S, Schumacher S, Galbraith I, Paterson MJ. Excited-State Absorption of Conjugated Polymers in the Near-Infrared and Visible: A Computational Study of Oligofluorenes. <i>The Journal of Physical Chemistry C</i>. Published online 2013:6889-6895. doi:<a href=\"https://doi.org/10.1021/jp401359a\">10.1021/jp401359a</a>","mla":"Ling, Sanliang, et al. “Excited-State Absorption of Conjugated Polymers in the Near-Infrared and Visible: A Computational Study of Oligofluorenes.” <i>The Journal of Physical Chemistry C</i>, 2013, pp. 6889–95, doi:<a href=\"https://doi.org/10.1021/jp401359a\">10.1021/jp401359a</a>.","chicago":"Ling, Sanliang, Stefan Schumacher, Ian Galbraith, and Martin J. Paterson. “Excited-State Absorption of Conjugated Polymers in the Near-Infrared and Visible: A Computational Study of Oligofluorenes.” <i>The Journal of Physical Chemistry C</i>, 2013, 6889–95. <a href=\"https://doi.org/10.1021/jp401359a\">https://doi.org/10.1021/jp401359a</a>.","short":"S. Ling, S. Schumacher, I. Galbraith, M.J. Paterson, The Journal of Physical Chemistry C (2013) 6889–6895.","ieee":"S. Ling, S. Schumacher, I. Galbraith, and M. J. Paterson, “Excited-State Absorption of Conjugated Polymers in the Near-Infrared and Visible: A Computational Study of Oligofluorenes,” <i>The Journal of Physical Chemistry C</i>, pp. 6889–6895, 2013, doi: <a href=\"https://doi.org/10.1021/jp401359a\">10.1021/jp401359a</a>.","apa":"Ling, S., Schumacher, S., Galbraith, I., &#38; Paterson, M. J. (2013). Excited-State Absorption of Conjugated Polymers in the Near-Infrared and Visible: A Computational Study of Oligofluorenes. <i>The Journal of Physical Chemistry C</i>, 6889–6895. <a href=\"https://doi.org/10.1021/jp401359a\">https://doi.org/10.1021/jp401359a</a>"},"project":[{"name":"Computing Resources Provided by the Paderborn Center for Parallel Computing","_id":"52"}],"date_created":"2020-02-10T12:03:41Z","type":"journal_article","department":[{"_id":"15"},{"_id":"170"},{"_id":"297"},{"_id":"35"},{"_id":"230"},{"_id":"27"}]},{"issue":"42","publication":"The Journal of Physical Chemistry C","type":"journal_article","keyword":["Surfaces","Coatings and Films","Physical and Theoretical Chemistry","General Energy","Electronic","Optical and Magnetic Materials"],"department":[{"_id":"306"}],"date_created":"2023-01-31T14:55:17Z","date_updated":"2023-01-31T14:55:33Z","publication_status":"published","intvolume":"       116","title":"Structure–Activity Studies on Highly Active Palladium Hydrogenation Catalysts by X-ray Absorption Spectroscopy","year":"2012","publication_identifier":{"issn":["1932-7447","1932-7455"]},"author":[{"first_name":"Matthias","orcid":"0000-0002-9294-6076","last_name":"Bauer","full_name":"Bauer, Matthias","id":"47241"},{"full_name":"Schoch, Roland","first_name":"Roland","orcid":"0000-0003-2061-7289","last_name":"Schoch","id":"48467"},{"full_name":"Shao, Lidong","last_name":"Shao","first_name":"Lidong"},{"full_name":"Zhang, Bingsen","last_name":"Zhang","first_name":"Bingsen"},{"full_name":"Knop-Gericke, Axel","first_name":"Axel","last_name":"Knop-Gericke"},{"first_name":"Marc","last_name":"Willinger","full_name":"Willinger, Marc"},{"full_name":"Schlögl, Robert","first_name":"Robert","last_name":"Schlögl"},{"full_name":"Teschner, Detre","last_name":"Teschner","first_name":"Detre"}],"doi":"10.1021/jp306962v","language":[{"iso":"eng"}],"citation":{"apa":"Bauer, M., Schoch, R., Shao, L., Zhang, B., Knop-Gericke, A., Willinger, M., Schlögl, R., &#38; Teschner, D. (2012). Structure–Activity Studies on Highly Active Palladium Hydrogenation Catalysts by X-ray Absorption Spectroscopy. <i>The Journal of Physical Chemistry C</i>, <i>116</i>(42), 22375–22385. <a href=\"https://doi.org/10.1021/jp306962v\">https://doi.org/10.1021/jp306962v</a>","ieee":"M. Bauer <i>et al.</i>, “Structure–Activity Studies on Highly Active Palladium Hydrogenation Catalysts by X-ray Absorption Spectroscopy,” <i>The Journal of Physical Chemistry C</i>, vol. 116, no. 42, pp. 22375–22385, 2012, doi: <a href=\"https://doi.org/10.1021/jp306962v\">10.1021/jp306962v</a>.","chicago":"Bauer, Matthias, Roland Schoch, Lidong Shao, Bingsen Zhang, Axel Knop-Gericke, Marc Willinger, Robert Schlögl, and Detre Teschner. “Structure–Activity Studies on Highly Active Palladium Hydrogenation Catalysts by X-Ray Absorption Spectroscopy.” <i>The Journal of Physical Chemistry C</i> 116, no. 42 (2012): 22375–85. <a href=\"https://doi.org/10.1021/jp306962v\">https://doi.org/10.1021/jp306962v</a>.","short":"M. Bauer, R. Schoch, L. Shao, B. Zhang, A. Knop-Gericke, M. Willinger, R. Schlögl, D. Teschner, The Journal of Physical Chemistry C 116 (2012) 22375–22385.","mla":"Bauer, Matthias, et al. “Structure–Activity Studies on Highly Active Palladium Hydrogenation Catalysts by X-Ray Absorption Spectroscopy.” <i>The Journal of Physical Chemistry C</i>, vol. 116, no. 42, American Chemical Society (ACS), 2012, pp. 22375–85, doi:<a href=\"https://doi.org/10.1021/jp306962v\">10.1021/jp306962v</a>.","ama":"Bauer M, Schoch R, Shao L, et al. Structure–Activity Studies on Highly Active Palladium Hydrogenation Catalysts by X-ray Absorption Spectroscopy. <i>The Journal of Physical Chemistry C</i>. 2012;116(42):22375-22385. doi:<a href=\"https://doi.org/10.1021/jp306962v\">10.1021/jp306962v</a>","bibtex":"@article{Bauer_Schoch_Shao_Zhang_Knop-Gericke_Willinger_Schlögl_Teschner_2012, title={Structure–Activity Studies on Highly Active Palladium Hydrogenation Catalysts by X-ray Absorption Spectroscopy}, volume={116}, DOI={<a href=\"https://doi.org/10.1021/jp306962v\">10.1021/jp306962v</a>}, number={42}, journal={The Journal of Physical Chemistry C}, publisher={American Chemical Society (ACS)}, author={Bauer, Matthias and Schoch, Roland and Shao, Lidong and Zhang, Bingsen and Knop-Gericke, Axel and Willinger, Marc and Schlögl, Robert and Teschner, Detre}, year={2012}, pages={22375–22385} }"},"status":"public","user_id":"48467","volume":116,"page":"22375-22385","_id":"41243","publisher":"American Chemical Society (ACS)"},{"issue":"10","publication":"The Journal of Physical Chemistry C","date_created":"2023-02-10T14:25:03Z","department":[{"_id":"314"}],"type":"journal_article","keyword":["Surfaces","Coatings and Films","Physical and Theoretical Chemistry","General Energy","Electronic","Optical and Magnetic Materials"],"publication_identifier":{"issn":["1932-7447","1932-7455"]},"author":[{"full_name":"Nayuk, R.","first_name":"R.","last_name":"Nayuk"},{"full_name":"Zacher, D.","first_name":"D.","last_name":"Zacher"},{"first_name":"R.","last_name":"Schweins","full_name":"Schweins, R."},{"full_name":"Wiktor, C.","last_name":"Wiktor","first_name":"C."},{"full_name":"Fischer, R. A.","first_name":"R. A.","last_name":"Fischer"},{"full_name":"van Tendeloo, G.","first_name":"G.","last_name":"van Tendeloo"},{"id":"237","full_name":"Huber, Klaus","first_name":"Klaus","last_name":"Huber"}],"title":"Modulated Formation of MOF-5 Nanoparticles—A SANS Analysis","year":"2012","intvolume":"       116","publication_status":"published","date_updated":"2023-02-10T14:25:32Z","language":[{"iso":"eng"}],"doi":"10.1021/jp3003728","citation":{"mla":"Nayuk, R., et al. “Modulated Formation of MOF-5 Nanoparticles—A SANS Analysis.” <i>The Journal of Physical Chemistry C</i>, vol. 116, no. 10, American Chemical Society (ACS), 2012, pp. 6127–35, doi:<a href=\"https://doi.org/10.1021/jp3003728\">10.1021/jp3003728</a>.","ama":"Nayuk R, Zacher D, Schweins R, et al. Modulated Formation of MOF-5 Nanoparticles—A SANS Analysis. <i>The Journal of Physical Chemistry C</i>. 2012;116(10):6127-6135. doi:<a href=\"https://doi.org/10.1021/jp3003728\">10.1021/jp3003728</a>","bibtex":"@article{Nayuk_Zacher_Schweins_Wiktor_Fischer_van Tendeloo_Huber_2012, title={Modulated Formation of MOF-5 Nanoparticles—A SANS Analysis}, volume={116}, DOI={<a href=\"https://doi.org/10.1021/jp3003728\">10.1021/jp3003728</a>}, number={10}, journal={The Journal of Physical Chemistry C}, publisher={American Chemical Society (ACS)}, author={Nayuk, R. and Zacher, D. and Schweins, R. and Wiktor, C. and Fischer, R. A. and van Tendeloo, G. and Huber, Klaus}, year={2012}, pages={6127–6135} }","apa":"Nayuk, R., Zacher, D., Schweins, R., Wiktor, C., Fischer, R. A., van Tendeloo, G., &#38; Huber, K. (2012). Modulated Formation of MOF-5 Nanoparticles—A SANS Analysis. <i>The Journal of Physical Chemistry C</i>, <i>116</i>(10), 6127–6135. <a href=\"https://doi.org/10.1021/jp3003728\">https://doi.org/10.1021/jp3003728</a>","ieee":"R. Nayuk <i>et al.</i>, “Modulated Formation of MOF-5 Nanoparticles—A SANS Analysis,” <i>The Journal of Physical Chemistry C</i>, vol. 116, no. 10, pp. 6127–6135, 2012, doi: <a href=\"https://doi.org/10.1021/jp3003728\">10.1021/jp3003728</a>.","chicago":"Nayuk, R., D. Zacher, R. Schweins, C. Wiktor, R. A. Fischer, G. van Tendeloo, and Klaus Huber. “Modulated Formation of MOF-5 Nanoparticles—A SANS Analysis.” <i>The Journal of Physical Chemistry C</i> 116, no. 10 (2012): 6127–35. <a href=\"https://doi.org/10.1021/jp3003728\">https://doi.org/10.1021/jp3003728</a>.","short":"R. Nayuk, D. Zacher, R. Schweins, C. Wiktor, R.A. Fischer, G. van Tendeloo, K. Huber, The Journal of Physical Chemistry C 116 (2012) 6127–6135."},"status":"public","_id":"41984","publisher":"American Chemical Society (ACS)","page":"6127-6135","volume":116,"user_id":"237"}]