@article{503c8d188adf4ad5857647e50791e8c9,
title = "Molecular library of OLED host materials—Evaluating the multiscale simulation workflow",
author = "Anirban Mondal and Leanne Paterson and Jaeyoung Cho and Kun-Han Lin and {van der Zee}, Bas and Wetzelaer, {Gert-Jan A. H.} and Andrei Stankevych and Alexander Vakhnin and Jang-Joo Kim and Andrey Kadashchuk and Blom, {Paul W. M.} and Falk May and Denis Andrienko",
note = "KAUST Repository Item: Exported on 2021-07-28 Acknowledged KAUST grant number(s): CRG Acknowledgements: D.A. acknowledges the BMBF Grant InterPhase (Grant No. FKZ13N13661) and the European Union Horizon 2020 Research and Innovation Programme {\textquoteleft}Widening Materials Models{\textquoteright} under Grant No. 646259 (MOSTOPHOS). This research has been supported by the King Abdullah University of Science and Technology (KAUST), via the Competitive Research Grants (CRG) Program. D.A. acknowledges KAUST for hosting his sabbatical. The Ukrainian team acknowledges funding through the EU Marie Sk{\l}odowska-Curie ITN TADFlife grant (Grant No. 812872). This research was also supported by the European Research Council under the ERC Grant No. 835133 (ULTRA-LUX), VW Foundation, and by the National Academy of Science of Ukraine (Project No. VC/205) and NRFU 2020.01/0144. K.-H.L. acknowledges the financial support from the Swiss NSF Early Postdoc Mobility fellowship (Grant No. P2ELP2_195156). This publication acknowledges KAUST support, but has no KAUST affiliated authors.",
year = "2021",
month = jul,
day = "26",
doi = "10.1063/5.0049513",
language = "English (US)",
volume = "2",
pages = "031304",
journal = "Chemical Physics Reviews",
issn = "2688-4070",
publisher = "American Institute of Physics",
number = "3",
}