

Geometrical, electronic structure, nonlinear optical and spectroscopic investigations of 4-(phenylthio)phthalonitrile dye sensitizer for solar cells using quantum chemical calculations
Ponnusamy Munusamy Anbarasan (1,*)






(1) Department of Physics, Periyar University, Salem-636 011, Tamilnadu, India
(2) Department of Physics, Periyar University, Salem-636 011, Tamilnadu, India
(3) Department of Physics, Periyar University, Salem-636 011, Tamilnadu, India
(4) Department of Physics, Periyar University, Salem-636 011, Tamilnadu, India
(5) Department of Physics, Periyar University, Salem-636 011, Tamilnadu, India
(6) Department of Physics, Periyar University, Salem-636 011, Tamilnadu, India
(*) Corresponding Author
Received: 02 Sep 2010 | Revised: 24 Jan 2011 | Accepted: 15 Feb 2011 | Published: 30 Jun 2011 | Issue Date: June 2011
Abstract

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DOI: 10.5155/eurjchem.2.2.206-213.269
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This work was partly financially supported by University Grants Commission, Govt. of India, New Delhi, within the Major Research Project scheme under the approval-cum-sanction Nos. F.No.34-5\2008(SR) and 34-1/TN/08.
Citations
[1]. David Casanova
The Role of the π Linker in Donor-π-Acceptor Organic Dyes for High-Performance Sensitized Solar Cells
ChemPhysChem 12(16), 2979, 2011
DOI: 10.1002/cphc.201100520

[2]. Hakan Arslan, Aydin Demircan, Gun Binzet, Ilhan Ozer Ilhan
Vibrational Spectroscopy Investigation Using Ab Initio and Density Functional Theory Analysis on the Structure oftert-Butyl 3a-Chloroperhydro-2,6a-epoxyoxireno[e]isoindole-5-carboxylate
Journal of Chemistry 2013, 1, 2013
DOI: 10.1155/2013/124659

[3]. Siyamak Shahab, Fatemeh Haji Hajikolaee, Liudmila Filippovich, Mahdieh Darroudi, Valery Aleksandrovich Loiko, Rakesh Kumar, Mostafa Yousefzadeh Borzehandani
Molecular structure and UV–Vis spectral analysis of new synthesized azo dyes for application in polarizing films
Dyes and Pigments 129, 9, 2016
DOI: 10.1016/j.dyepig.2016.02.003

[4]. Siyamak Shahab, Liudmila Filippovich, M. Aharodnikova, Hora A. Almodarresiyeh, Fatemeh Haji Hajikolaee, Rakesh Kumar, Mahsa Mashayekhi
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DOI: 10.1016/j.molstruc.2016.12.038

[5]. Zakia Messasma, Ali Ourari, Rachid Mahdadi, Selma Houchi, Djouhra Aggoun, Abdallah Kherbache, Embarek Bentouhami
Synthesis, spectral characterization, DFT computational studies and inhibitory activity of novel N 2 S 2 tetradentates Schiff bases on metallo-beta-lactamases of Acinetobacter baumannii
Journal of Molecular Structure 1171, 672, 2018
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[6]. Emel Önal, Tuğba Muhlise Okyay, Gülçin Ekineker, Ümit İşci, Vefa Ahsen, Savaş Berber, Yunus Zorlu, Fabienne Dumoulin
Sulfanyl vs sulfonyl, 4,5- vs 3,6- position. How structural variations in phthalonitrile substitution affect their infra-red, crystallographic and Hirshfeld surface analyses
Journal of Molecular Structure 1155, 310, 2018
DOI: 10.1016/j.molstruc.2017.10.069

[7]. Serpil Eryılmaz, Nesuhi Akdemir, Ersin İnkaya
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Spectroscopy Letters 52(1), 28, 2019
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[8]. João V. P. Valverde, André G. Pelosi, Leandro H. Zucolotto. Cocca, Orlando D. Marbello, Julie le Bescont, Chloé Breton-Patient, Sandrine Piguel, Daniel L. Silva, Leonardo De Boni, Cleber R. Mendonça
Two-photon absorption in imidazo[1,2-a]pyridine derivatives: Study of nonlinear optical response and dipolar properties
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DOI: 10.1016/j.molliq.2023.121250

[9]. Abdullah Aydin, Hakan Arslan, Murat Şüküroğlu, Mehmet Akkurt, Orhan Büyükgüngör
Crystal Structure and Vibrational Spectra of 3-Chloro-4-Phenyl-6-(Morpholine-4-yl)-Pyridazine by Hartree-Fock and Density Functional Methods
Molecular Crystals and Liquid Crystals 606(1), 216, 2015
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[10]. Muzaffer Köç, Yunus Zorlu, Ümit İşci, Savaş Berber, Vefa Ahsen, Fabienne Dumoulin
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[11]. Siyamak Shahab, Hora A. Almodarresiyeh, Ljudmila Filippovich, Rakesh Kumar, Mahdieh Darroudi, Fatemeh Haji Hajikolaee
Synthesis of biphenyl derivative and its application as dichroic materials in poly (vinyl alcohol) polarizing films
Journal of Molecular Structure 1107, 19, 2016
DOI: 10.1016/j.molstruc.2015.11.024

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