A computational and experimental investigation of deep-blue light-emitting tetraaryl-benzobis[1,2-<i>d</i>:4,5-<i>d</i>′]oxazoles-Reference-Cited by-同舟云学术

A computational and experimental investigation of deep-blue light-emitting tetraaryl-benzobis[1,2-d:4,5-d′]oxazoles

Published:2022 Issue:9 Volume:3 Page:3842-3852
ISSN:2633-5409
Container-title:Materials Advances
language:en
Short-container-title:Mater. Adv.

Author:

Wheeler D.¹,Tannir S.¹^ORCID,Smith E.²,Tomlinson A.²,Jeffries-EL M.¹³^ORCID

Affiliation:

1. Department of Chemistry, Boston University, Boston, MA 02215, USA

2. Department of Chemistry and Biochemistry, University of North Georgia, Dahlonega, GA 30041, USA

3. Division of Materials Science and Engineering, Boston University, Boston, MA 02215, USA

Abstract

In an effort to design deep-blue light emitting materials for use in OLEDs, the optical and electronic properties of a series of tetraarylbenzobis[1,2-d:4,5-d′]oxazole (BBO) cruciforms were evaluated using density functional theory (DFT) and time-dependent DFT (TD-DFT).

Funder

Division of Chemistry

Division of Materials Research

Publisher

Royal Society of Chemistry (RSC)

Subject

General Materials Science,Chemistry (miscellaneous)

Link

http://pubs.rsc.org/en/content/articlepdf/2022/MA/D1MA00990G

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