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The Computational Carbon Chemistry (CCC) group uses state-of-the-art computational chemistry to explore and exploit diverse functional organic materials. Among these, graphene-based materials are of particular interest due to a number of advantages they offer over conventional inorganic counterparts: natural biocompatibility, infinite structural variability, mechanical flexibility, unique electronic and optical properties, relative ease of fabrication and functionalisation, and inherent molecular ...
Public web page: https://www.h-its.org/research/ccc/
Start date: 1st Apr 2019
End date: 31st Mar 2024
Organisms: Not specified
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Authors: Miray Cetin, Veronica Pinamonti, Theresa Schmid, Tamara Boschert, Ana Mellado Fuentes, Kristina Kromer, Taga Lerner, Jing Zhang, Yonatan Herzig, Christopher Ehlert, Miguel Hernandez-Hernandez, Georgios Samaras, Claudia Maldonado Torres, Laura Fisch, Valeriia Dragan, Arlette Kouwenhoven, Bertrand Van Schoubroeck, Hans Wils, Carl Van Hove, Michael Platten, Edward W. Green, Frederik Stevenaert, Nathan J. Felix, John M. Lindner
Date Published: 2nd Feb 2024
Publication Type: Journal
Citation: Sci. Adv. 10(5),eadk3060
Abstract
Authors: Christopher Ehlert, Anna Piras, Ganna Gryn’ova
Date Published: 3rd Oct 2023
Publication Type: Journal
Citation: ACS Omega 8(39):35768-35778
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Authors: Christopher Ehlert, Anna Piras, Juliette Schleicher, Ganna Gryn’ova
Date Published: 19th Jan 2023
Publication Type: Journal
DOI: 10.1021/acs.jpclett.2c03481
Citation: J. Phys. Chem. Lett. 14(2):476-480
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Authors: D. Mayer, F. Lever, D. Picconi, J. Metje, S. Alisauskas, F. Calegari, S. Düsterer, C. Ehlert, R. Feifel, M. Niebuhr, B. Manschwetus, M. Kuhlmann, T. Mazza, M. S. Robinson, R. J. Squibb, A. Trabattoni, M. Wallner, P. Saalfrank, T. J. A. Wolf, M. Gühr
Date Published: 1st Dec 2022
Publication Type: Journal
DOI: 10.1038/s41467-021-27908-y
Citation: Nat Commun 13(1),198
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Authors: Auguste Tetenoire, Christopher Ehlert, J. I. Juaristi, Peter Saalfrank, M. Alducin
Date Published: 15th Sep 2022
Publication Type: Journal
DOI: 10.1021/acs.jpclett.2c02327
Citation: J. Phys. Chem. Lett. 13(36):8516-8521