A DFT/TDDFT mission to probe push–pull vinyl coupled thiophene oligomers for optoelectronic applications-Reference-Cited by-同舟云学术

A DFT/TDDFT mission to probe push–pull vinyl coupled thiophene oligomers for optoelectronic applications

Published:2015 Issue:62 Volume:5 Page:50353-50364
ISSN:2046-2069
Container-title:RSC Advances
language:en
Short-container-title:RSC Adv.

Author:

Gajalakshmi Duraikannu¹²³,Solomon Rajadurai Vijay⁴⁵⁶⁷³,Tamilmani Venkatachalam¹⁸³,Boobalan Mariasusai¹⁹¹⁰³,Venuvanalingam Ponnambalam⁴⁵⁶⁷³

Affiliation:

1. Department of Chemistry

2. University College of Engineering Villupuram (A Constituent College of Anna University, Chennai)

3. India

4. Theoretical and Computational Chemistry Laboratory

5. School of Chemistry

6. Bharathidasan University

7. Tiruchirappalli-620024

8. University College of Engineering Ariyalur (A Constituent College of Anna University, Chennai)

9. St. Joseph's College

10. Tiruchirapalli

Abstract

VCTO encompassing pull–pull and push–pull categories has been appraised for fine tuning of band gaps and optoelectronic application through DFT/TDDFT calculations.

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2015/RA/C5RA01466B

Reference74 articles.

1. Improved the efficiency of small molecule organic solar cell by double anode buffer layers

2. Theoretical Characterization of the PC60BM:PDDTT Model for an Organic Solar Cell

3. Tuning the Photophysical Properties of 2-Quinolinone-Based Donor-Acceptor Molecules throughN- versusO-Alkylation: Insights from Experimental and Theoretical Investigations

4. Photoinduced Degradation Studies of Organic Solar Cell Materials Using Kelvin Probe Force and Conductive Scanning Force Microscopy

5. Hole capture dynamics of phenyl-capped thiophene: Direct ab-initio molecular dynamics study

Cited by 22 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Computational Insights into the Fusion of Thiophene to Aza BODIPY Based Molecules for Better Organic Solar Cell Applications;Chemical Physics Impact;2024-06

2. Single crystal of barium bis para-nitrophenolate para-nitrophenol tetrahydrate for NLO applications: crystal growth and DFT analysis;Zeitschrift für Physikalische Chemie;2024-03-11

3. Theoretical investigations on electronic structure and optoelectronic properties of vinyl fused monomeric and oligomeric benzimidazole derivatives using DFT and TDDFT techniques;Journal of Molecular Modeling;2024-01-16

4. Computational exploration of the structure-photophysical property relationship of 2,6-dicyanoaniline derivatives for optoelectronic applications;Journal of Molecular Structure;2024-01

5. Conjugation-modulated optoelectronic and anti-corrosion properties of pyrrole oligomer: Insights from DFT/TD-DFT analysis;Journal of Molecular Structure;2024-01