A donor–acceptor type organic dye connected with a quinoidal thiophene for dye-sensitized solar cells

2013 ◽  
Vol 15 (9) ◽  
pp. 3227 ◽  
Author(s):  
Makoto Komatsu ◽  
Jotaro Nakazaki ◽  
Satoshi Uchida ◽  
Takaya Kubo ◽  
Hiroshi Segawa

2010 ◽  
Vol 12 (1) ◽  
pp. 12-15 ◽  
Author(s):  
Daniel Heredia ◽  
Jose Natera ◽  
Miguel Gervaldo ◽  
Luis Otero ◽  
Fernando Fungo ◽  
...  


2015 ◽  
Vol 137 (11) ◽  
pp. 3799-3802 ◽  
Author(s):  
Zhaoyang Yao ◽  
Min Zhang ◽  
Heng Wu ◽  
Lin Yang ◽  
Renzhi Li ◽  
...  


ChemSusChem ◽  
2013 ◽  
Vol 6 (12) ◽  
pp. 2322-2329 ◽  
Author(s):  
Ming Cheng ◽  
Xichuan Yang ◽  
Jianghua Zhao ◽  
Cheng Chen ◽  
Qin Tan ◽  
...  


2013 ◽  
Vol 49 (69) ◽  
pp. 7587 ◽  
Author(s):  
Jian Liu ◽  
Youhei Numata ◽  
Chuanjiang Qin ◽  
Ashraful Islam ◽  
Xudong Yang ◽  
...  


2011 ◽  
Vol 21 (15) ◽  
pp. 5573 ◽  
Author(s):  
Ling Li ◽  
Xichuan Yang ◽  
Jianzhang Zhao ◽  
Jiajia Gao ◽  
Anders Hagfeldt ◽  
...  


2019 ◽  
Vol 43 (17) ◽  
pp. 6480-6491 ◽  
Author(s):  
Narendra Nath Ghosh ◽  
Md. Habib ◽  
Anup Pramanik ◽  
Pranab Sarkar ◽  
Sougata Pal

Triazatruxene with designed anchoring groups provides better photovoltaic activities.



2014 ◽  
Vol 2014 ◽  
pp. 1-11 ◽  
Author(s):  
Reda M. El-Shishtawy ◽  
Shaaban A. Elroby ◽  
Abdullah M. Asiri ◽  
Rifaat H. Hilal

In an effort to provide, assess, and evaluate a theoretical approach which enables designing efficient donor-acceptor dye systems, the electronic structure and optical properties of pyran-squaraine as donor-acceptor dyes used in dye-sensitized solar cells were investigated. Ground state properties have been computed at the B3LYP/6-31+G**level of theory. The long-range corrected density functionals CAM-B3LYP, PBEPBE, PBE1PBE (PBE0), and TPSSH with 6-311++G**were employed to examine absorption properties of the studied dyes. In an extensive comparison between experimental results and ab initio benchmark calculations, the TPSSH functional with 6-311++G**basis set was found to be the most appropriate in describing the electronic properties for the studied pyran and squaraine dyes. Natural transition orbitals (NTO), frontier molecular orbitals (FMO), LUMO, HOMO, and energy gaps, of these dyes, have been analyzed to show their effect on the process of electron injection and dye regeneration. Interaction between HOMO and LUMO of pyran and squaraine dyes was investigated to understand the recombination process and charge-transfer process involving these dyes. Additionally, we performed natural bond orbital (NBO) analysis to investigate the role of charge delocalization and hyperconjugative interactions in the stability of the molecule.



2009 ◽  
Vol 54 (16) ◽  
pp. 4123-4130 ◽  
Author(s):  
Kun-Mu Lee ◽  
Vembu Suryanarayanan ◽  
Jen-Hsien Huang ◽  
K.R. Justin Thomas ◽  
Jiann T. Lin ◽  
...  


2014 ◽  
Vol 20 (6) ◽  
Author(s):  
Reda M. El-Shishtawy ◽  
Abdullah M. Asiri ◽  
Saadullah G. Aziz ◽  
Shaaban A. K. Elroby


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