“Hot exciton” fluorescence and charge transport of fine-tuned twistacenes: theoretical study on substitution effect and intermolecular interactions-Reference-Cited by-同舟云学术

“Hot exciton” fluorescence and charge transport of fine-tuned twistacenes: theoretical study on substitution effect and intermolecular interactions

Published:2023 Issue:8 Volume:47 Page:3847-3855
ISSN:1144-0546
Container-title:New Journal of Chemistry
language:en
Short-container-title:New J. Chem.

Author:

Wei Xiaoye¹,Liu Ziyang¹,Zhang Kaixuan¹,Zhao Zilin¹,Zhang Wei¹,Han Qian¹,Ma Gang¹^ORCID,Zhang Chunfang¹^ORCID

Affiliation:

1. College of Chemistry and Environmental Science, Hebei University, Baoding, 071002, China

Abstract

New twistacene 1 and its CH3, OH, OCH3, NH2, F, CN and NO2derivatives were simulated and their photoelectronic and charge transport properties investigatedviatheoretical calculations.

Funder

Natural Science Foundation of Hebei Province

National Natural Science Foundation of China

Hebei University

Publisher

Royal Society of Chemistry (RSC)

Subject

Materials Chemistry,General Chemistry,Catalysis

Link

http://pubs.rsc.org/en/content/articlepdf/2023/NJ/D2NJ05560K

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