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Volumn 5, Issue 13, 2014, Pages 2171-2176

Structure-photoluminescence correlation for two crystalline polymorphs of a thiophene-phenylene co-oligomer with bulky terminal substituents

Author keywords

CH interaction; conjugated OLED material; parallel versus herringbone stack; photoluminescence QY; TD DFT excited states; thiophene phenylene co oligomer

Indexed keywords

CALCULATIONS; EXCITED STATES; PHOTOLUMINESCENCE; QUANTUM CHEMISTRY; THIOPHENE;

EID: 84903841060     PISSN: None     EISSN: 19487185     Source Type: Journal    
DOI: 10.1021/jz500925r     Document Type: Article
Times cited : (37)

References (39)
  • 1
  • 2
    • 78751489958 scopus 로고    scopus 로고
    • The Thiophene/Phenylene Co-Oligomers: Exotic Molecular Semiconductors Integrating High-Performance Electronic and Optical Functionalities
    • Hotta, S.; Yamao, T. The Thiophene/Phenylene Co-Oligomers: Exotic Molecular Semiconductors Integrating High-Performance Electronic and Optical Functionalities J. Mater. Chem. 2011, 21, 1295-1304
    • (2011) J. Mater. Chem. , vol.21 , pp. 1295-1304
    • Hotta, S.1    Yamao, T.2
  • 5
    • 23744502937 scopus 로고    scopus 로고
    • Novel thiophene-aryl co-oligomers for organic thin film transistors
    • DOI 10.1039/b504044b
    • Tian, H.; Wang, J.; Shi, J.; Yan, D.; Wang, L.; Geng, Y.; Wang, F. Novel Thiophene-Aryl Co-Oligomers for Organic Thin Film Transistors J. Mater. Chem. 2005, 15, 3026-3033 (Pubitemid 41120284)
    • (2005) Journal of Materials Chemistry , vol.15 , Issue.29 , pp. 3026-3033
    • Tian, H.1    Wang, J.2    Shi, J.3    Yan, D.4    Wang, L.5    Geng, Y.6    Wang, F.7
  • 6
    • 33646730993 scopus 로고    scopus 로고
    • Excitons in Conjugated Oligomer Aggregates, Films, and Crystals
    • Spano, J. C. Excitons in Conjugated Oligomer Aggregates, Films, and Crystals Annu. Rev. Phys. Chem. 2006, 57, 217-243
    • (2006) Annu. Rev. Phys. Chem. , vol.57 , pp. 217-243
    • Spano, J.C.1
  • 8
    • 34248350451 scopus 로고    scopus 로고
    • Multiple mode exciton-phonon coupling: Applications to photoluminescence in oligothiophene thin films
    • DOI 10.1021/jp067927r
    • Zhao, Z.; Spano, F. C. Multiple Mode Exciton-Phonon Coupling: Applications to Photoluminescence in Oligothiophene Thin Films J. Phys. Chem. C 2007, 111, 6113-6123 (Pubitemid 46732912)
    • (2007) Journal of Physical Chemistry C , vol.111 , Issue.16 , pp. 6113-6123
    • Zhao, Z.1    Spano, F.C.2
  • 10
    • 84883410098 scopus 로고    scopus 로고
    • Amplified Spontaneous Emission and Electroluminescence from Thiophene/Phenylene Co-Oligomer-Doped p -Bis(p -styrylstyryl)benzene Crystals
    • Nakanotani, H.; Adachi, C. Amplified Spontaneous Emission and Electroluminescence from Thiophene/Phenylene Co-Oligomer-Doped p -Bis(p -styrylstyryl)benzene Crystals Adv. Opt. Mater. 2013, 1, 422-427
    • (2013) Adv. Opt. Mater. , vol.1 , pp. 422-427
    • Nakanotani, H.1    Adachi, C.2
  • 11
    • 84868353668 scopus 로고    scopus 로고
    • Single Crystals of 5,5′-Bis(4′-methoxybiphenyl-4-yl)-2, 2′-bithiophene for Organic Laser Media
    • Mizuno, H.; Haku, U.; Marutani, Y.; Ishizumi, A.; Yanagi, H.; Sasaki, F.; Hotta, S. Single Crystals of 5,5′-Bis(4′-methoxybiphenyl-4-yl)-2, 2′-bithiophene for Organic Laser Media Adv. Mater. 2012, 24, 5744-5749
    • (2012) Adv. Mater. , vol.24 , pp. 5744-5749
    • Mizuno, H.1    Haku, U.2    Marutani, Y.3    Ishizumi, A.4    Yanagi, H.5    Sasaki, F.6    Hotta, S.7
  • 12
    • 0035793783 scopus 로고    scopus 로고
    • Epitaxial growth of thiophene/p-phenylene co-oligomers for highly polarized light-emitting crystals
    • DOI 10.1002/1521-4095(200103)13: 5<313::AID-ADMA313>3.0.CO;2-0
    • Yanagi, H.; Morikawa, T.; Hotta, S.; Yase, K. Epitaxial Growth of Thiophene/ p -Phenylene Co-oligomers for Highly Polarized Light-Emitting Crystals Adv. Mater. 2001, 13, 313-317 (Pubitemid 32271530)
    • (2001) Advanced Materials , vol.13 , Issue.5 , pp. 313-317
    • Yanagi, H.1    Morikawa, T.2    Hotta, S.3    Yase, K.4
  • 13
    • 30844450117 scopus 로고    scopus 로고
    • Origin of the Amplified Spontaneous Emission from Thiophene/Phenylene Co-Oligomer Single Crystals: Towards Co-Oligomer Lasers
    • Bando, K.; Nakamura, T.; Kobayashi, S.; Masumoto, Y.; Sasaki, F.; Hotta, S. Origin of the Amplified Spontaneous Emission from Thiophene/Phenylene Co-Oligomer Single Crystals: Towards Co-Oligomer Lasers J. Appl. Phys. 2006, 99, 13518/1-13518/6
    • (2006) J. Appl. Phys. , vol.99
    • Bando, K.1    Nakamura, T.2    Kobayashi, S.3    Masumoto, Y.4    Sasaki, F.5    Hotta, S.6
  • 15
    • 84882329423 scopus 로고    scopus 로고
    • Luminescent Distyrylbenzenes: Tailoring Molecular Structure and Crystalline Morphology
    • Gierschner, J.; Park, S. Y. Luminescent Distyrylbenzenes: Tailoring Molecular Structure and Crystalline Morphology J. Mater. Chem. C 2013, 1, 5818-5832
    • (2013) J. Mater. Chem. C , vol.1 , pp. 5818-5832
    • Gierschner, J.1    Park, S.Y.2
  • 16
    • 1642274590 scopus 로고    scopus 로고
    • Crystal Structures and Spectroscopic Characterization of Radical Cations and Dications of Oligothiophenes Stabilized by Annelation with Bicyclo[2.2.2]octene Units: Sterically Segregated Cationic Oligothiophenes
    • DOI 10.1021/ja039434v
    • Nishinaga, T.; Wakamiya, A.; Yamazaki, D.; Komatsu, K. Crystal Structures and Spectroscopic Characterization of Radical Cations and Dications of Oligothiophenes Stabilized by Annelation with Bicyclo[2.2.2]octene Units: Sterically Segregated Cationic Oligothiophenes J. Am. Chem. Soc. 2004, 126, 3163-3174 (Pubitemid 38380721)
    • (2004) Journal of the American Chemical Society , vol.126 , Issue.10 , pp. 3163-3174
    • Nishinaga, T.1    Wakamiya, A.2    Yamazaki, D.3    Komatsu, K.4
  • 18
    • 0034128961 scopus 로고    scopus 로고
    • Structural Order in Conjugated Oligothiophenes and Its Implications on Opto-Electronic Devices
    • Fichou, D. Structural Order in Conjugated Oligothiophenes and Its Implications on Opto-Electronic Devices J. Mater. Chem. 2000, 10, 571-588
    • (2000) J. Mater. Chem. , vol.10 , pp. 571-588
    • Fichou, D.1
  • 19
    • 0031143184 scopus 로고    scopus 로고
    • Conformational polymorphism of oligothiophenes: X-ray structure of the monoclinic form of 3,3′,4″,3-tetrakis(methylsulfanyl)-2,2′: 5′, 2″:5″,2-quaterthiophene
    • Barbarella, G.; Zambianchi, M.; Del Fresno, I.; Marimon, M.; Antolini, L.; Bongini, A. Conformational Polymorphism of Oligothiophenes: X-Ray Structure of the Monoclinic Form of 3,3,4,3-Tetrakis(methylsulfany- l)2,2′:5′, 2′:5′,2″-Quaterthiophene Adv. Mater. 1997, 9, 484-487 (Pubitemid 127527638)
    • (1997) Advanced Materials , vol.9 , Issue.6 , pp. 484-487
    • Barbarella, G.1    Zambianchi, M.2    Del Fresno I Marimon, M.3    Antolini, L.4    Bongini, A.5
  • 21
    • 1842502860 scopus 로고    scopus 로고
    • Solid-State Packing of Conjugated Oligomers: From π-Stacks to the Herringbone Structure
    • DOI 10.1021/ja0397916
    • Curtis, M. D.; Cao, J.; Kampf, J. W. Solid-State Packing of Conjugated Oligomers: From π-Stacks to the Herringbone Structure J. Am. Chem. Soc. 2004, 126, 4318-4328 (Pubitemid 38453891)
    • (2004) Journal of the American Chemical Society , vol.126 , Issue.13 , pp. 4318-4328
    • Curtis, M.D.1    Cao, J.2    Kampf, J.W.3
  • 23
    • 33645898818 scopus 로고
    • Accurate and Simple Analytic Representation of the Electron-Gas Correlation Energy
    • Perdew, J. P.; Wang, Y. Accurate and Simple Analytic Representation of the Electron-Gas Correlation Energy Phys. Rev. B 1992, 45, 13244-13249
    • (1992) Phys. Rev. B , vol.45 , pp. 13244-13249
    • Perdew, J.P.1    Wang, Y.2
  • 24
    • 0034319689 scopus 로고    scopus 로고
    • From Molecules to Solids with the DMol3 Approach
    • Delley, B. From Molecules to Solids with the DMol3 Approach J. Chem. Phys. 2000, 113, 7756-7761
    • (2000) J. Chem. Phys. , vol.113 , pp. 7756-7761
    • Delley, B.1
  • 25
    • 77954921561 scopus 로고    scopus 로고
    • Interaction of meso-Tetraphenylporphines with C60 Fullerene: Comparison of Several Density Functional Theory Functionals Implemented in DMol3 Module
    • Kolokoltsev, Y.; Amelines-Sarria, O.; Gromovoy, T. Y.; Basiuk, V. A. Interaction of meso-Tetraphenylporphines with C60 Fullerene: Comparison of Several Density Functional Theory Functionals Implemented in DMol3 Module J. Comput. Theor. Nanosci. 2010, 7, 1095-1103
    • (2010) J. Comput. Theor. Nanosci. , vol.7 , pp. 1095-1103
    • Kolokoltsev, Y.1    Amelines-Sarria, O.2    Gromovoy, T.Y.3    Basiuk, V.A.4
  • 26
    • 77955673236 scopus 로고    scopus 로고
    • Noncovalent 1:2 Complex of meso-Tetraphenylporphine with C60 Fullerene: A Density Functional Theory Study
    • Amelines-Sarria, O.; Kolokoltsev, Y.; Basiuk, V. A. Noncovalent 1:2 Complex of meso-Tetraphenylporphine with C60 Fullerene: A Density Functional Theory Study J. Comput. Theor. Nanosci. 2010, 7, 1996-2003
    • (2010) J. Comput. Theor. Nanosci. , vol.7 , pp. 1996-2003
    • Amelines-Sarria, O.1    Kolokoltsev, Y.2    Basiuk, V.A.3
  • 27
    • 79955416747 scopus 로고    scopus 로고
    • A Density Functional Theory Study of Porphyrin-Pyridine-Fullerene Triad ZnTPP·Py·C60
    • Basiuk, V. A.; Amelines-Sarria, O.; Kolokoltsev, Y. A Density Functional Theory Study of Porphyrin-Pyridine-Fullerene Triad ZnTPP·Py·C60 J. Comput. Theor. Nanosci. 2010, 7, 2322-2330
    • (2010) J. Comput. Theor. Nanosci. , vol.7 , pp. 2322-2330
    • Basiuk, V.A.1    Amelines-Sarria, O.2    Kolokoltsev, Y.3
  • 28
    • 80053569963 scopus 로고    scopus 로고
    • Electron Smearing in DFT Calculations: A Case Study of Doxorubicin Interaction with Single-Walled Carbon Nanotubes
    • Basiuk, V. A. Electron Smearing in DFT Calculations: A Case Study of Doxorubicin Interaction with Single-Walled Carbon Nanotubes Int. J. Quantum Chem. 2011, 15, 4197-4205
    • (2011) Int. J. Quantum Chem. , vol.15 , pp. 4197-4205
    • Basiuk, V.A.1
  • 29
    • 0345724795 scopus 로고    scopus 로고
    • Structures, Electronic States, and Electroluminescent Properties of a Zinc(II) 2-(2-Hydroxyphenyl)benzothiazolate Complex
    • DOI 10.1021/ja0371505
    • Yu, G.; Yin, S.; Liu, Y.; Shuai, Z.; Zhu, D. Structures, Electronic States, and Electroluminescent Properties of a Zinc(II) 2-(2-Hydroxyphenyl) benzothiazolate Complex J. Am. Chem. Soc. 2003, 125, 14816-14824 (Pubitemid 37475571)
    • (2003) Journal of the American Chemical Society , vol.125 , Issue.48 , pp. 14816-14824
    • Yu, G.1    Yin, S.2    Liu, Y.3    Shuai, Z.4    Zhu, D.5
  • 30
    • 84885103406 scopus 로고    scopus 로고
    • Solid State Transformations in Stoichiometric Hydrogen Bonded Molecular Salts: Ionic Interconversion and Dehydration Processes
    • Guo, F.; Zhang, M. Q.; Famulari, A.; Martí-Rujas, J. Solid State Transformations in Stoichiometric Hydrogen Bonded Molecular Salts: Ionic Interconversion and Dehydration Processes CrystEngComm 2013, 15, 6237-6243
    • (2013) CrystEngComm , vol.15 , pp. 6237-6243
    • Guo, F.1    Zhang, M.Q.2    Famulari, A.3    Martí-Rujas, J.4
  • 31
    • 84892744951 scopus 로고    scopus 로고
    • Mechanochemical Dehydrochlorination and Chelation Reaction in the Solid State: From a Molecular Salt to a Coordination Complex
    • Guo, F.; Shao, H.; Yang, Q.; Famulari, A.; Martí-Rujas, J. Mechanochemical Dehydrochlorination and Chelation Reaction in the Solid State: From a Molecular Salt to a Coordination Complex CrystEngComm 2014, 16, 969-973
    • (2014) CrystEngComm , vol.16 , pp. 969-973
    • Guo, F.1    Shao, H.2    Yang, Q.3    Famulari, A.4    Martí-Rujas, J.5
  • 33
    • 84871013750 scopus 로고    scopus 로고
    • A Solid State Density Functional Study of Crystalline Thiophene-Based Oligomers and Polymers
    • Famulari, A.; Raos, G.; Casalegno, M.; Po, R.; Meille, S. V. A Solid State Density Functional Study of Crystalline Thiophene-Based Oligomers and Polymers J. Phys. Chem. B 2012, 116, 14504-14509
    • (2012) J. Phys. Chem. B , vol.116 , pp. 14504-14509
    • Famulari, A.1    Raos, G.2    Casalegno, M.3    Po, R.4    Meille, S.V.5
  • 34
    • 84882368595 scopus 로고    scopus 로고
    • Highly Emissive H-Aggregates or Aggregation-Induced Emission Quenching? the Photophysics of All-Trans para -Distyrylbenzene
    • Gierschner, J.; Lüer, L.; Milián-Medina, B.; Oelkrug, D.; Egelhaaf, H.-J. Highly Emissive H-Aggregates or Aggregation-Induced Emission Quenching? The Photophysics of All-Trans para -Distyrylbenzene J. Phys. Chem. Lett. 2013, 4, 2686-2697
    • (2013) J. Phys. Chem. Lett. , vol.4 , pp. 2686-2697
    • Gierschner, J.1    Lüer, L.2    Milián-Medina, B.3    Oelkrug, D.4    Egelhaaf, H.-J.5
  • 35
    • 0036759653 scopus 로고    scopus 로고
    • Density matrix analysis and simulation of electronic excitations in conjugated and aggregated molecules
    • DOI 10.1021/cr0101252
    • Tretiak, S.; Mukamel, S. Density Matrix Analysis and Simulation of Electronic Excitations in Conjugated and Aggregated Molecules Chem. Rev. 2002, 102, 3171-3212 (Pubitemid 35381644)
    • (2002) Chemical Reviews , vol.102 , Issue.9 , pp. 3171-3212
    • Tretiak, S.1    Mukamel, S.2
  • 36
    • 44949197892 scopus 로고    scopus 로고
    • Evolution of the Bipolaronic Structure in Going from One- to Two-Dimensional π Model Systems
    • Ottonelli, M.; Musso, G.; Dellepiane, G. Evolution of the Bipolaronic Structure in Going From One- to Two-Dimensional π Model Systems J. Phys. Chem. A 2008, 112, 3991-3995
    • (2008) J. Phys. Chem. A , vol.112 , pp. 3991-3995
    • Ottonelli, M.1    Musso, G.2    Dellepiane, G.3
  • 37
    • 77955981901 scopus 로고    scopus 로고
    • A Computational Investigation on Singlet and Triplet Exciton Couplings in Acene Molecular Crystals
    • Quarti, C.; Fazzi, D.; Tommasini, M. A Computational Investigation on Singlet and Triplet Exciton Couplings in Acene Molecular Crystals Chem. Phys. Lett. 2010, 496, 284-290
    • (2010) Chem. Phys. Lett. , vol.496 , pp. 284-290
    • Quarti, C.1    Fazzi, D.2    Tommasini, M.3


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