MOHAN KUMAR, S and KANNAIAN, T and SATHYANARAYANA MOORTH, V (2018) The effect of substituted 2,5-Diphenyloxazole on DSSC performance: A theoretical study. International Journal of Advanced Research and Development, 3 (2). pp. 1154-1159. ISSN 2455-4030

[thumbnail of The effect of substituted 2,5-Diphenyloxazole on DSSC performance A theoretical study.pdf] Text
The effect of substituted 2,5-Diphenyloxazole on DSSC performance A theoretical study.pdf - Published Version
Download (646kB)

Abstract

Theoretical analysis of the 2,5-diphenyloxazole dye molecule and newly designed dyes were performed using Density Functional Theory. The ground state and excited state oxidation potential as well as electron injection from dyes to TiO2 are reported. Improved light harvesting efficiency and free energy change of electron injection of newly designed sensitizers reveal that these materials would be excellent sensitizers. This theoretical designing will pave way for the experimental list to synthesis the efficient
sensitizers for solar cells. The study of structural, electronic and optical properties for these compounds could help to design more efficient functional photovoltaic organic materials

Item Type: Article
Uncontrolled Keywords: DSSC, LHE, DFT, 2,5-diphenyloxazole
Divisions: PSG College of Arts and Science > Department of Electronics
Depositing User: Users 1 not found.
Date Deposited: 29 Dec 2021 10:59
Last Modified: 29 Dec 2021 10:59
URI: http://ir.psgcas.ac.in/id/eprint/269

Actions (login required)

View Item
View Item
Altmetric