A Joint Theoretical and Experimental Study on a Tetrazole-Anchored BODIPY-Based Dye at the Surface of TiO2 for Dye-Sensitized Solar Cell Applications

被引:7
作者
Akdogan, Nurdan [1 ]
Ortatepe, Burcu [2 ]
Atli, Aycan [3 ]
Disli, Ali [1 ]
Erdogdu, Yusuf [4 ]
Yildiz, Abdullah [3 ]
机构
[1] Gazi Univ, Fac Sci, Dept Chem, TR-06500 Ankara, Turkiye
[2] Gazi Univ, Grad Sch Nat & Appl Sci, Dept Phys, TR-06400 Ankara, Turkiye
[3] Ankara Yildirim Beyazit Univ, Fac Engn & Nat Sci, Dept Energy Syst Engn, TR-06010 Ankara, Turkiye
[4] Gazi Univ, Fac Sci, Dept Phys, TR-06500 Ankara, Turkiye
来源
PHYSICA STATUS SOLIDI A-APPLICATIONS AND MATERIALS SCIENCE | 2024年 / 221卷 / 03期
关键词
BODIPY; density functional theory; dye-sensitized solar cells; synthesis; tetrazole; POLYMER ELECTROLYTE MEMBRANES; ELECTROCHEMICAL PROPERTIES; HIGHLY-EFFICIENT; DENSITY FUNCTIONALS; ORGANIC-DYES; PERFORMANCE; ENERGY; DESIGN; THERMOCHEMISTRY; 1ST-PRINCIPLES;
D O I
10.1002/pssa.202300513
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
The performance of the created BODIPY-based dye compound in dye-sensitized solar cells is evaluated. The electrical and charge transport characteristics of the dye are examined using the density functional theory and time-dependent density functional theory. By calculating E-HOMO, E-LUMO, lambda(max), E-ex, light-harvesting efficiency, reorganization energy, and the free injection energy (Delta G(inj)), attributes of the dye are identified. In comparison to the performance of N719 dye (5.16%), the device performance of synthesized BODIPY dye is reported to have an efficiency of 0.34%. Electrochemical outcomes are consistent with the efficiency outcomes and have a larger charge transport resistance for BODIPY (85.9 Omega) than for N719 (6.1 Omega).
引用
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页数:11
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共 82 条
  • [21] Lignin-Based Polymer Electrolyte Membranes for Sustainable Aqueous Dye-Sensitized Solar Cells
    de Haro, Juan Carlos
    Tatsi, Elisavet
    Fagiolari, Lucia
    Bonomo, Matteo
    Barolo, Claudia
    Turri, Stefano
    Bella, Federico
    Griffini, Gianmarco
    [J]. ACS SUSTAINABLE CHEMISTRY & ENGINEERING, 2021, 9 (25): : 8550 - 8560
  • [22] Structural and Electronic Properties of Ti Doped Aluminum Clusters: Density Functional Theory Calculations
    Erdogdu, Yusuf
    Erkoc, Sakir
    [J]. JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE, 2012, 9 (06) : 837 - 850
  • [23] A panchromatic boradiazaindacene (BODIPY) sensitizer for dye-sensitized solar cells
    Erten-Ela, Sule
    Yilmaz, M. Deniz
    Icli, Burcak
    Dede, Yavuz
    Icli, Siddik
    Akkaya, Engin U.
    [J]. ORGANIC LETTERS, 2008, 10 (15) : 3299 - 3302
  • [24] Synthesis of a dibenzo-BODIPY-incorporating phenothiazine dye as a panchromatic sensitizer for dye-sensitized solar cells
    Erten-Ela, Sule
    Ueno, Yoshihide
    Asaba, Takuro
    Kubo, Yuji
    [J]. NEW JOURNAL OF CHEMISTRY, 2017, 41 (18) : 10367 - 10375
  • [25] Physicochemical and computational insight of 19F NMR and emission properties of meso-(o-aryl)-BODIPYs
    Farfan-Paredes, Monica
    Gonzalez-Antonio, Oscar
    Tahuilan-Anguiano, Diana E.
    Peon, Jorge
    Ariza, Armando
    Lacroix, Pascal G.
    Santillan, Rosa
    Farfan, Norberto
    [J]. NEW JOURNAL OF CHEMISTRY, 2020, 44 (45) : 19459 - 19471
  • [26] Frisch M. J., 2019, GAUSSIAN 16 REVISION
  • [27] "Scorpion"-shaped mono(carboxy)porphyrin-(BODIPY)2, a novel triazine bridged triad: synthesis, characterization and dye sensitized solar cell (DSSC) applications
    Galateia, Zervaki E.
    Agapi, Nikiforou
    Vasilis, Nikolaou
    Sharma, Ganesh D.
    Athanassios, Coutsolelos G.
    [J]. JOURNAL OF MATERIALS CHEMISTRY C, 2015, 3 (22) : 5652 - 5664
  • [28] Characterization and charge transfer properties of organic BODIPY dyes integrated in TiO2 nanotube based dye-sensitized solar cells
    Gonzalez-Valls, I.
    Mirloup, A.
    Le Bahers, T.
    Keller, N.
    Cottineau, T.
    Sautet, P.
    Keller, V.
    [J]. RSC ADVANCES, 2016, 6 (94): : 91529 - 91540
  • [29] Charge separation in a nonfluorescent donor-acceptor dyad derived from boron dipyrromethene dye, leading to photocurrent generation
    Hattori, S
    Ohkubo, K
    Urano, Y
    Sunahara, H
    Nagano, T
    Wada, Y
    Tkachenko, NV
    Lemmetyinen, H
    Fukuzumi, S
    [J]. JOURNAL OF PHYSICAL CHEMISTRY B, 2005, 109 (32) : 15368 - 15375
  • [30] Highly-efficient metal-free organic dyes for dye-sensitized solar cells
    Horiuchi, T
    Miura, H
    Uchida, S
    [J]. CHEMICAL COMMUNICATIONS, 2003, (24) : 3036 - 3037