Assessment of time-dependent density functionals for the electronic excitation energies of organic dyes used in DSSCs-Reference-Cited by-同舟云学术

Assessment of time-dependent density functionals for the electronic excitation energies of organic dyes used in DSSCs

Published:2022 Issue:16 Volume:46 Page:7682-7694
ISSN:1144-0546
Container-title:New Journal of Chemistry
language:en
Short-container-title:New J. Chem.

Author:

Alkhatib Qabas¹,Helal Wissam¹^ORCID,Afaneh Akef T.²

Affiliation:

1. Department of Chemistry, The University of Jordan, Amman 11942, Jordan

2. Department of Chemistry, Al-Balqa Applied University, 19117 Al-Salt, Jordan

Abstract

The absorption spectra modeled as the vertical excitation energies of 13 dye sensitizers used in dye-sensitized solar cells (DSSCs) are benchmarked by means of time-dependent (TD)-DFT, using 36 functionals from different DFT rungs.

Funder

Deanship of Academic Research, University of Jordan

Publisher

Royal Society of Chemistry (RSC)

Subject

Materials Chemistry,General Chemistry,Catalysis

Link

http://pubs.rsc.org/en/content/articlepdf/2022/NJ/D2NJ00210H

Reference130 articles.

1. Dye-Sensitized Solar Cells

2. Meso-Substituted Porphyrins for Dye-Sensitized Solar Cells

3. Recent advances in dye-sensitized solar cells: from photoanodes, sensitizers and electrolytes to counter electrodes

4. Insight into D–A−π–A Structured Sensitizers: A Promising Route to Highly Efficient and Stable Dye-Sensitized Solar Cells

5. Triarylamine: Versatile Platform for Organic, Dye-Sensitized, and Perovskite Solar Cells

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