Geometries, electronic structures and vibrational spectral studies of 4-aminophthalonitrile using quantum chemical calculations for dye sensitized solar cells

2011 ◽  
Vol 85 (10) ◽  
pp. 1477-1494 ◽  
Author(s):  
P. M. Anbarasan ◽  
P. Senthil Kumar ◽  
K. Vasudevan ◽  
R. Govindan ◽  
V. Aroulmoji
Keyword(s):  
Solar Cells ◽  
Quantum Chemical Calculations ◽  
Electronic Structures ◽  
Quantum Chemical ◽  
Dye Sensitized Solar Cells ◽  
Spectral Studies ◽  
Dye Sensitized ◽  
Sensitized Solar Cells

scholarly journals Efficient tuning of zinc phthalocyanine-based dyes for dye-sensitized solar cells: a detailed DFT study

RSC Advances ◽  
2021 ◽  
Vol 11 (44) ◽  
pp. 27570-27582
Author(s):  
Sabir Ali Siddique ◽  
Muhammad Arshad ◽  
Sabiha Naveed ◽  
Muhammad Yasir Mehboob ◽  
Muhammad Adnan ◽  
...  
Keyword(s):  
Solar Cells ◽  
Quantum Chemical ◽  
Dye Sensitized Solar Cells ◽  
Optoelectronic Properties ◽  
Dft Study ◽  
Zinc Phthalocyanine ◽  
Dye Sensitized ◽  
Td Dft ◽  
Quantum Chemical Approach ◽  
Sensitized Solar Cells

We used a quantum chemical approach to investigate the optoelectronic properties of dyes T1–T5 for dye-sensitized solar cells using DFT and TD-DFT computation. The newly designed molecules exhibited outstanding photovoltaic and optoelectronic properties.

Quantum chemical modeling of components of dye-sensitized solar cells

2013 ◽  
Vol 68 (2) ◽  
pp. 77-79 ◽  
Author(s):  
I. V. Polyakov ◽  
A. A. Moskovskii ◽  
M. G. Khrenova ◽  
A. V. Nemukhin
Keyword(s):  
Solar Cells ◽  
Quantum Chemical ◽  
Dye Sensitized Solar Cells ◽  
Quantum Chemical Modeling ◽  
Chemical Modeling ◽  
Dye Sensitized ◽  
Sensitized Solar Cells
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