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Volumn 117, Issue 5, 2013, Pages 2245-2251

A rational design for dye sensitizer: Density functional theory study on the electronic absorption spectra of organoimido-substituted hexamolybdates

Author keywords

[No Author keywords available]

Indexed keywords

CHARGE SEPARATIONS; CONJUGATED BRIDGES; DYE SENSITIZERS; DYE-SENSITIZED SOLAR CELL; ELECTRONIC ABSORPTION SPECTRA; HEXAMOLYBDATES; LIGHT-HARVESTING; ORGANIC-INORGANIC HYBRID; P-TYPE; RATIONAL DESIGN; TIME DEPENDENT DENSITY FUNCTIONAL THEORY; VISIBLE REGION;

EID: 84873456458     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp3106452     Document Type: Article
Times cited : (43)

References (41)
  • 1
    • 77956112581 scopus 로고    scopus 로고
    • Improvement of Dye-Sensitized Solar Cells: What We Know and What We Need to Know
    • Ning, Z. J.; Fu, Y.; Tian, H. Improvement of Dye-Sensitized Solar Cells: What We Know and What We Need to Know Energy Environ. Sci. 2010, 3, 1170-1181
    • (2010) Energy Environ. Sci. , vol.3 , pp. 1170-1181
    • Ning, Z.J.1    Fu, Y.2    Tian, H.3
  • 2
    • 26444515561 scopus 로고    scopus 로고
    • Solar Spectral Optical Properties of Pigments-Part I: Model for Deriving Scattering and Absorption Coefficients from Transmittance and Reflectance Measurements
    • Ronnen, L.; Paul, B.; Hashem, A. Solar Spectral Optical Properties of Pigments-Part I: Model for Deriving Scattering and Absorption Coefficients from Transmittance and Reflectance Measurements Sol. Energy Mater. Sol. Cells. 2005, 89, 319-349
    • (2005) Sol. Energy Mater. Sol. Cells. , vol.89 , pp. 319-349
    • Ronnen, L.1    Paul, B.2    Hashem, A.3
  • 6
    • 0342894499 scopus 로고
    • Electrochemical Investigations on the Spectral Sensitization of Gallium Phosphide Electrodes
    • Memming, R.; Tributsch, H. Electrochemical Investigations on the Spectral Sensitization of Gallium Phosphide Electrodes J. Phys. Chem. 1971, 75, 562-570
    • (1971) J. Phys. Chem. , vol.75 , pp. 562-570
    • Memming, R.1    Tributsch, H.2
  • 8
    • 0029326020 scopus 로고
    • Deposition of Thin Polycrystalline Films of Cuprous Thiocyanate on Conducting Glass and Photoelectrochemical Dye-Sensitization
    • Tennakone, K.; Kumarasinghe, A. R.; Sirimanne, P. M.; Kumara, G. R. R. A. Deposition of Thin Polycrystalline Films of Cuprous Thiocyanate on Conducting Glass and Photoelectrochemical Dye-Sensitization Thin Solid Films 1995, 261, 307-310
    • (1995) Thin Solid Films , vol.261 , pp. 307-310
    • Tennakone, K.1    Kumarasinghe, A.R.2    Sirimanne, P.M.3    Kumara, G.R.R.A.4
  • 9
    • 0000084530 scopus 로고    scopus 로고
    • Dye-Sensitized Nanostructured p-Type Nickel Oxide Film as A Photocathode for A Solar Cell
    • He, J. J.; Lindström, H.; Hagfeldt, A.; Lindquist, S. E. Dye-Sensitized Nanostructured p-Type Nickel Oxide Film as A Photocathode for A Solar Cell J. Phys. Chem. B 1999, 103, 8940-8943
    • (1999) J. Phys. Chem. B , vol.103 , pp. 8940-8943
    • He, J.J.1    Lindström, H.2    Hagfeldt, A.3    Lindquist, S.E.4
  • 10
    • 77955682114 scopus 로고    scopus 로고
    • New Photovoltaic Devices Based on the Sensitization of p-Type Semiconductors: Challenges and Opportunities
    • Odobel, F.; Pleux, L. L.; Pellegrin, Y.; Blart, E. New Photovoltaic Devices Based on the Sensitization of p-Type Semiconductors: Challenges and Opportunities Acc. Chem. Res. 2010, 43, 1063-1071
    • (2010) Acc. Chem. Res. , vol.43 , pp. 1063-1071
    • Odobel, F.1    Pleux, L.L.2    Pellegrin, Y.3    Blart, E.4
  • 11
    • 79960998641 scopus 로고    scopus 로고
    • Linker Effect in Organic Donor-Acceptor Dyes for p-Type NiO Dye Sensitized Solar Cells
    • Ji, Z. Q.; Natu, G.; Huang, Z. J.; Wu, Y. Y. Linker Effect in Organic Donor-Acceptor Dyes for p-Type NiO Dye Sensitized Solar Cells Energy Environ. Sci. 2011, 4, 2818-2821
    • (2011) Energy Environ. Sci. , vol.4 , pp. 2818-2821
    • Ji, Z.Q.1    Natu, G.2    Huang, Z.J.3    Wu, Y.Y.4
  • 13
    • 78651421557 scopus 로고    scopus 로고
    • A Density Functional Theory and Time-Dependent Density Functional Theory Investigation on the Anchor Comparison of Triarylamine-Based Dyes
    • Peng, B.; Yang, S. Q.; Li, L. L.; Cheng, F. Y.; Chen, J. A Density Functional Theory and Time-Dependent Density Functional Theory Investigation on the Anchor Comparison of Triarylamine-Based Dyes J. Chem. Phys. 2010, 132, 034305
    • (2010) J. Chem. Phys. , vol.132 , pp. 034305
    • Peng, B.1    Yang, S.Q.2    Li, L.L.3    Cheng, F.Y.4    Chen, J.5
  • 14
    • 77649193831 scopus 로고    scopus 로고
    • Dipolar Compounds Containing Fluorene and A Heteroaromatic Ring as the Conjugating Bridge for High-Performance Dye-Sensitized Solar Cells
    • Chen, C. H.; Hsu, Y. C.; Chou, H. H.; Thomas, K. R. J; Lin, J. T.; Hsu, C. P. Dipolar Compounds Containing Fluorene and A Heteroaromatic Ring as the Conjugating Bridge for High-Performance Dye-Sensitized Solar Cells Chem.-Eur. J. 2010, 16, 3184-3193
    • (2010) Chem. - Eur. J. , vol.16 , pp. 3184-3193
    • Chen, C.H.1    Hsu, Y.C.2    Chou, H.H.3    Thomas, K.R.J.4    Lin, J.T.5    Hsu, C.P.6
  • 17
    • 0031649081 scopus 로고    scopus 로고
    • Electrochemical Properties of Polyoxometalates as Electrocatalysts
    • Sadakane, M.; Steckhan, E. Electrochemical Properties of Polyoxometalates as Electrocatalysts Chem. Rev. 1998, 98, 219-237
    • (1998) Chem. Rev. , vol.98 , pp. 219-237
    • Sadakane, M.1    Steckhan, E.2
  • 18
    • 0034802280 scopus 로고    scopus 로고
    • An Efficient and Convenient Reaction Protocol to Organoimido Derivatives of Polyoxometalates
    • Wei, Y. G.; Xu, B. B.; Barnes, C. L.; Peng, Z. H. An Efficient and Convenient Reaction Protocol to Organoimido Derivatives of Polyoxometalates J. Am. Chem. Soc. 2001, 123, 4083-4084
    • (2001) J. Am. Chem. Soc. , vol.123 , pp. 4083-4084
    • Wei, Y.G.1    Xu, B.B.2    Barnes, C.L.3    Peng, Z.H.4
  • 19
    • 68949137062 scopus 로고    scopus 로고
    • Synthetic, Structural, Spectroscopic, Electrochemical Studies and Self-Assembly of Nanoscale Polyoxometalate-Organic Hybrid Molecular Dumbbells
    • Zhu, Y.; Wang, L. S.; Hao, J. Z.; Xiao, C.; Wei, Y. G.; Wang, Y. Synthetic, Structural, Spectroscopic, Electrochemical Studies and Self-Assembly of Nanoscale Polyoxometalate-Organic Hybrid Molecular Dumbbells Cryst. Growth Des. 2009, 9, 3509-3518
    • (2009) Cryst. Growth Des. , vol.9 , pp. 3509-3518
    • Zhu, Y.1    Wang, L.S.2    Hao, J.Z.3    Xiao, C.4    Wei, Y.G.5    Wang, Y.6
  • 21
    • 77951682114 scopus 로고    scopus 로고
    • Polyoxometalatocyclophanes: Controlled Assembly of Polyoxometalate-Based Chiral Metallamacrocycles from Achiral Building Blocks
    • Xiao, F. P.; Hao, J.; Zhang, J.; Lv, C. L.; Yin, P. C.; Wang, L. S.; Wei, Y. G. Polyoxometalatocyclophanes: Controlled Assembly of Polyoxometalate-Based Chiral Metallamacrocycles from Achiral Building Blocks J. Am. Chem. Soc. 2010, 132, 5956-5957
    • (2010) J. Am. Chem. Soc. , vol.132 , pp. 5956-5957
    • Xiao, F.P.1    Hao, J.2    Zhang, J.3    Lv, C.L.4    Yin, P.C.5    Wang, L.S.6    Wei, Y.G.7
  • 22
    • 34347208325 scopus 로고    scopus 로고
    • Naphthylimido-Substituted Hexamolybdate: Preparation, Crystal Structures, Solvent Effects, and Optical Properties of Tree Plymorphs
    • Hao, J.; Ruhlmann, L.; Zhu, Y. L.; Li, Q.; Wei, Y. G. Naphthylimido-Substituted Hexamolybdate: Preparation, Crystal Structures, Solvent Effects, and Optical Properties of Tree Plymorphs Inorg. Chem. 2007, 46, 4960-4967
    • (2007) Inorg. Chem. , vol.46 , pp. 4960-4967
    • Hao, J.1    Ruhlmann, L.2    Zhu, Y.L.3    Li, Q.4    Wei, Y.G.5
  • 23
    • 20744455681 scopus 로고    scopus 로고
    • Synthesis and Optical Properties of Conjugated Polymers Containing Polyoxometalate Clusters as Side-Chain Pendants
    • Xu, B. B.; Lu, M.; Kang, J.; Wang, D. G.; Brown, J.; Peng, Z. H. Synthesis and Optical Properties of Conjugated Polymers Containing Polyoxometalate Clusters as Side-Chain Pendants Chem. Mater. 2005, 17, 2841-2851
    • (2005) Chem. Mater. , vol.17 , pp. 2841-2851
    • Xu, B.B.1    Lu, M.2    Kang, J.3    Wang, D.G.4    Brown, J.5    Peng, Z.H.6
  • 24
    • 12344283547 scopus 로고    scopus 로고
    • Synthesis of Main-Chain Polyoxometalate-Containing Hybrid Polymers and Their Applications in Photovoltaic Cells
    • Lu, M.; Xie, B. H.; Kang, J.; Chen, F. C.; Yang, Y.; Peng, Z. H. Synthesis of Main-Chain Polyoxometalate-Containing Hybrid Polymers and Their Applications in Photovoltaic Cells Chem. Mater. 2005, 17, 402-408
    • (2005) Chem. Mater. , vol.17 , pp. 402-408
    • Lu, M.1    Xie, B.H.2    Kang, J.3    Chen, F.C.4    Yang, Y.5    Peng, Z.H.6
  • 26
    • 78649719357 scopus 로고    scopus 로고
    • Enhanced Photovoltaic Response by Incorporating Polyoxometalate into a Phthalocyanine-Sensitized Electrode
    • Yang, Y. B.; Xu, L.; Li, F. Y.; Du, X. G.; Sun, Z. X. Enhanced Photovoltaic Response by Incorporating Polyoxometalate into a Phthalocyanine-Sensitized Electrode J. Mater. Chem. 2010, 20, 10835-10840
    • (2010) J. Mater. Chem. , vol.20 , pp. 10835-10840
    • Yang, Y.B.1    Xu, L.2    Li, F.Y.3    Du, X.G.4    Sun, Z.X.5
  • 27
    • 72849108485 scopus 로고    scopus 로고
    • Molecular Understanding of Organic Solar Cells: The Challenges
    • Brédas, J. L.; Norton, J. E.; Cornil, J.; Coropceanu, V. Molecular Understanding of Organic Solar Cells: The Challenges Acc. Chem. Res. 2009, 42, 1691-1699
    • (2009) Acc. Chem. Res. , vol.42 , pp. 1691-1699
    • Brédas, J.L.1    Norton, J.E.2    Cornil, J.3    Coropceanu, V.4
  • 28
    • 80055064385 scopus 로고    scopus 로고
    • Theoretical Studies of Dye-Sensitised Solar Cells: From Electronic Structure to Elementary Processes
    • Martsinovich, N.; Troisi, A. Theoretical Studies of Dye-Sensitised Solar Cells: from Electronic Structure to Elementary Processes Energy Environ. Sci. 2011, 4, 4473-4495
    • (2011) Energy Environ. Sci. , vol.4 , pp. 4473-4495
    • Martsinovich, N.1    Troisi, A.2
  • 29
    • 33645392241 scopus 로고    scopus 로고
    • Design Rules for Donors in Bulk-Heterojunction Solar Cells-Towards 10% Energy-Conversion Efficiency
    • Scharber, M. C.; Mühlbacher, D.; Koppe, M.; Denk, P.; Waldauf, C.; Heeger, A. J.; Brabec, C. J. Design Rules for Donors in Bulk-Heterojunction Solar Cells-Towards 10% Energy-Conversion Efficiency Adv. Mater. 2006, 18, 789-794
    • (2006) Adv. Mater. , vol.18 , pp. 789-794
    • Scharber, M.C.1    Mühlbacher, D.2    Koppe, M.3    Denk, P.4    Waldauf, C.5    Heeger, A.J.6    Brabec, C.J.7
  • 30
    • 83455235315 scopus 로고    scopus 로고
    • Density Functional Theory Characterization and Design of High-Performance Diarylamine-Fluorene Dyes with Different π Spacers for Dye-Sensitized Solar Cells
    • Zhang, J.; Li, H. B.; Sun, S. L.; Geng, Y.; Wu, Y.; Su, Z. M. Density Functional Theory Characterization and Design of High-Performance Diarylamine-Fluorene Dyes with Different π Spacers for Dye-Sensitized Solar Cells J. Mater. Chem. 2012, 22, 568-576
    • (2012) J. Mater. Chem. , vol.22 , pp. 568-576
    • Zhang, J.1    Li, H.B.2    Sun, S.L.3    Geng, Y.4    Wu, Y.5    Su, Z.M.6
  • 31
    • 77949826052 scopus 로고    scopus 로고
    • Electronic Properties of Unprecedented Bridging Organoimido-Substituted Hexamolybdate: New Insights from Density Functional Theory Study
    • Yan, L. K.; Jin, M. S.; Song, P.; Su, Z. M. Electronic Properties of Unprecedented Bridging Organoimido-Substituted Hexamolybdate: New Insights from Density Functional Theory Study J. Phys. Chem. B 2010, 114, 3754-3758
    • (2010) J. Phys. Chem. B , vol.114 , pp. 3754-3758
    • Yan, L.K.1    Jin, M.S.2    Song, P.3    Su, Z.M.4
  • 34
    • 84873461999 scopus 로고    scopus 로고
    • ADF2002.03, SCM, Theoretical Chemistry, Vrije Universiteit, Amsterdam, The Netherlands.
    • ADF2002.03, SCM, Theoretical Chemistry, Vrije Universiteit, Amsterdam, The Netherlands, http://www.scm.com.
  • 35
    • 0000211269 scopus 로고    scopus 로고
    • Molecular Calculations of Excitation Energies and (hyper)Polarizabilities with A Statistical Average of Orbital Model Exchange-Correlation Potentials
    • Schipper, P. R. T.; Gritsenko, O. V.; van Gisbergen, S. J. A.; Baerends, E. J. Molecular Calculations of Excitation Energies and (hyper)Polarizabilities with A Statistical Average of Orbital Model Exchange-Correlation Potentials J. Chem. Phys. 2000, 112, 1344-1352
    • (2000) J. Chem. Phys. , vol.112 , pp. 1344-1352
    • Schipper, P.R.T.1    Gritsenko, O.V.2    Van Gisbergen, S.J.A.3    Baerends, E.J.4
  • 36
    • 78449307271 scopus 로고    scopus 로고
    • Charge Photogeneration in Organic Solar Cells
    • Tracey, M. C.; James, R. D. Charge Photogeneration in Organic Solar Cells Chem. Rev. 2010, 110, 6736-6767
    • (2010) Chem. Rev. , vol.110 , pp. 6736-6767
    • Tracey, M.C.1    James, R.D.2
  • 37
    • 80055052197 scopus 로고    scopus 로고
    • Investigation of the Photoinduced Electron Injection Processes for p-Type Triphenylamine-Sensitized Solar Cells
    • Preat, J.; Hagfeldt, A.; Perpète, E. A. Investigation of The Photoinduced Electron Injection Processes for p-Type Triphenylamine-Sensitized Solar Cells Energy Environ. Sci. 2011, 4, 4537-4549
    • (2011) Energy Environ. Sci. , vol.4 , pp. 4537-4549
    • Preat, J.1    Hagfeldt, A.2    Perpète, E.A.3
  • 38
    • 84863012443 scopus 로고    scopus 로고
    • Perylene Imides for Organic Photovoltaics: Yesterday, Today, and Tomorrow
    • Li, C.; Wonneberger, H. Perylene Imides for Organic Photovoltaics: Yesterday, Today, and Tomorrow Adv. Mater. 2012, 24, 613-636
    • (2012) Adv. Mater. , vol.24 , pp. 613-636
    • Li, C.1    Wonneberger, H.2
  • 39
    • 79960707806 scopus 로고    scopus 로고
    • A Rational Design Strategy for Donors in Organic Solar Cells: The Conjugated Planar Molecules Possessing Anisotropic Multibranches and Intramolecular Charge Transfer
    • Yong, X.; Zhang, J. P. A Rational Design Strategy for Donors in Organic Solar Cells: the Conjugated Planar Molecules Possessing Anisotropic Multibranches and Intramolecular Charge Transfer J. Mater. Chem. 2011, 21, 11159-11166
    • (2011) J. Mater. Chem. , vol.21 , pp. 11159-11166
    • Yong, X.1    Zhang, J.P.2
  • 41
    • 79957778498 scopus 로고    scopus 로고
    • Theoretical Procedure for Optimizing Dye-Sensitized Solar Cells: From Electronic Structure to Photovoltaic Efficiency
    • Bahers, T. L.; Labat, F.; Pauporté, T.; Lainé, P. P.; Ciofini, I. Theoretical Procedure for Optimizing Dye-Sensitized Solar Cells: from Electronic Structure to Photovoltaic Efficiency J. Am. Chem. Soc. 2011, 133, 8005-8013
    • (2011) J. Am. Chem. Soc. , vol.133 , pp. 8005-8013
    • Bahers, T.L.1    Labat, F.2    Pauporté, T.3    Lainé, P.P.4    Ciofini, I.5


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