Efficient Dye-sensitized Solar Cells Research Articles

Combine Improvement for Dye-Sensitized Solar Cells

Dye Sensitized-Solar Cells (DSSC) represent a third-generation solar cell technology based on photoelectrochemical principles. This study explores the use of Clitoria ternatea (butterfly pea) extract as an organic dye for DSSCs, focusing on its ability to absorb sunlight effectively. Excitation of electrons triggered by light in photocatalysis is strongly influenced by the position of the band gap. To be effective as a photocatalyst, the material must have a conduction band with a high positive potential compared to the electron accepting potential. Doping metal oxides such as CuO, MgO, Fe2O3, and ZnO into TiO2 can change the band edge properties or surface states which can increase light absorption. This research presents the synthesis of TiO2 nanoparticles as photoanodes doped using metal oxides to evaluate characteristic that can influence DSSC performance. TiO2 nanoparticles doped with metal oxide were synthesized using the solvothermal method and characterized by XRD, SEM-EDX, FTIR, and UV-Vis. Comprehensive analysis of samples doped with metal oxides significantly affects the crystal structure, morphology, elemental composition, and optical properties of the material. The results showed that Cu-doped TiO2 samples allowed for the most significant performance improvement in DSSC, followed by Fe-doped TiO2, Mg-doped TiO2, and Zn-doped TiO2, with pure TiO2 having the lowest performance potential. These results provide important insights into material optimization to improve DSSC efficiency.

Harnessing PbZrO3-Polymer composites for enhanced electron collection through advanced interfacial engineering

The integration of metal oxide-polymer composites into energy conversion devices presents a promising strategy for improving electron collection efficiency. This study addresses the performance challenges faced by Dye-Sensitized Solar Cells (DSSCs), particularly in enhancing light absorption and charge carrier transport. The investigate the use of hybrid PbZrO3-Polymer composites, specifically PbZrO3 Perovskite combined with PNMPy-PoA conducting polymers, to optimize electron collection in these devices. Utilizing advanced characterization techniques, including structural analysis, morphological studies, and electrochemical measurements, Author explore the synergistic interactions between the metal oxides and polymers. By incorporating PbZrO3 nanoparticles with conducting polymers (poly-o-anisidine and poly-N-methyl pyrrole) and organic DTTCY dyes, synergetic achieves a significant improvement in the power conversion efficiency (PCE) of DSSCs. Our results reveal that the optimized PNMPy-PoA-PbZrO3 counter electrode exhibits a photoelectric conversion efficiency of 3.46 % under ideal conditions, with reduced charge transfer resistance at the electrolyte-counter electrode interface. These findings highlight the effectiveness of hybrid metal oxide-polymer composites in enhancing electron collection and stability, offering substantial improvements in the performance of energy conversion devices.

Optimizing dye-sensitized solar cell efficiency through TiO2/CuS doping: effects of internal parameter variations

Dye-sensitized solar cells (DSSC) have attracted significant research interest due to their semi-transparency, ease of fabrication, cost-effectiveness, and environmental friendliness. This research focuses on enhancing dye-sensitized solar cells efficiency by doping titanium dioxide with copper sulfide and varying internal parameters such as concentration, thickness, and temperature. The primary issue addressed is the low electron mobility of titanium dioxide, which limits its performance as a photoanode. Using simulation methods, this study analyzed dye-sensitized solar cells performance under different doping conditions. The results showed that the highest efficiency of 8.18 % was achieved at a TiO2/CuS concentration of 0.3 %. The optimal photoanode thickness was approximately 3 μm, yielding an efficiency of 8.33 %. Temperature variations at room temperature (275 K, 300 K, and 325 K) resulted in efficiency values of 13.94 %, 15.06 %, and 16.18 %, respectively. These findings indicate that targeted doping and precise control of internal parameters can significantly enhance the performance of titanium dioxide-based dye-sensitized solar cells. The improved efficiency is attributed to enhanced electron mobility and better structural and morphological characteristics of the doped titanium dioxide photoanode. This research provides valuable insights into developing more efficient and sustainable dye-sensitized solar cells. The practical implications of these results are significant for advancing dye-sensitized solar cells as a viable alternative to conventional solar cells, contributing to the global effort to address the energy crisis by providing a cost-effective and environmentally friendly energy source.

A stable copper-modified bipyridine mediator for highly efficient dye-sensitized solar cells

A stable copper-modified bipyridine mediator for highly efficient dye-sensitized solar cells

Optimized Nb‐Doped TiO2/rGO Nanocomposites for Assessment of Photovoltaic Performance With Metal‐Free Dye and Polymer Gel Electrolyte

AbstractThis research presents the development of niobium (Nb)‐doped titania (TiO2)/reduced graphene oxide (rGO) nanocomposites (NTR NCs) for dye‐sensitized solar cells (DSSCs). The novelty lies in two aspects: introducing Nb (V) ions into TiO2/rGO nanocomposites via an in‐situ sol‐gel method with doping concentrations from 1.0 to 3.0 mol %, and fabricating photoanodes using the doctor blade technique, sensitized with a Co2+/Co3+‐based PEO‐PEG polymer gel electrolyte‐assisted D‐π‐A carbazole metal‐free (SK3) dye. Detailed investigations into the optoelectrical, structural, and morphological properties were conducted using various spectral and analytical tools. Notably, DSSCs based on Nb‐doped TiO2/rGO nanocomposites with 2.0 mol % Nb (NTR‐2) achieved a remarkable solar efficiency (η) of 5.48 % under AM 1.5 solar simulation, significantly outperforming devices based on bare TiO2 nanoparticles and undoped TiO2/rGO NCs by factors of 4.15 and 2.97, respectively. The substantial enhancement in photovoltaic performance is attributed to superior charge transfer properties and higher carrier density, as revealed by electrochemical impedance spectroscopy (EIS) and Mott‐Schottky (M–S) analysis. Nb‐doping results in an energetic surface nature, improved optical absorption, and reduced charge transfer resistance, collectively boosting the overall efficiency of DSSCs. This work underscores the potential of Nb‐doped TiO2/rGO NCs as effective photoanode materials in enhancing DSSC performance.

An improved supply of anthocyanin dye for creation of effective dye-sensitized solar cells grounded on natural dyes

Abstract In order to advance the power conversion efficiency of dye-sensitized solar cells, this article shows the selection of better sources of the sensitizer anthocyanin. The cells were created by combining liquid and solid electrolytes, adding natural dye, and employing a photo anode of aluminium-doped zinc oxide and a counter electrode of fluorine-doped tin oxide. Light harvesting efficiency, scanning electron microscopy, ultraviolet and infrared spectroscopy, and other methods were used to characterise the cells. From all the combinations made utilising different sources, the cell based on the D1 dye sample from Hibiscus sabdariffa L. (Manipur) had the best efficiency at 1.58 %. An effective DSSC was the end result of this strategy for identifying the optimal extraction source for anthocyanin natural dyes.

Improved preparation of AgNW film and its application in flexible counter electrodes of dye-sensitized and perovskite solar cells

Silver nanowire (AgNW) has been wildly used to prepare flexible conducting substrate of electronic and optoelectronic devices. By coating a layer of carbon onto a polymer/AgNW substrate, a counter electrode (CE) was obtained and it offers the advantages of high flexibility, light weight, low cost, simple fabrication, and operating efficiently in dye-sensitized solar cells (DSSCs) and perovskite solar cells (PSCs). By modifying the traditional unidirectional roll-coating process of AgNW to cross-directional coating, the morphology and distribution of the AgNW network was improved, which led to increased transmittance and electroconductivity, and subsequently improved cell efficiency of DSSCs and PSCs. The performance of the CEs and solar cells was further promoted by optimized fabrication process of the carbon layer. The as-prepared flexible CEs achieved great enhancement of cell efficiencies, and maximum power conversion efficiencies of 5.17% and 14.32% were obtained by DSSCs and PSCs, respectively.

A polysaccharide extracted from guar beans-based gel polymer electrolytes for efficient dye-sensitized solar cells

Liquid electrolytes in dye-sensitized solar cells (DSSCs), while effective in minimizing recombination of TiO2 conduction band with redox couple (I−/I3−), suffer from leakage and evaporation issues, hindering commercialization. Although solid-state electrolytes were introduced as an alternative, their performance is constrained by poor electrode contact. To solve these issues, gel polymer electrolytes (GPE) have been formulated based on guar gum (GG) crosslinked with poly (ethylene glycol) (PEG 200) incorporating potassium iodide (KI) as the doping salt. The incorporation of PEG 200 into the GPE allows a stable gel polymer electrolyte to form by using dimethyl sulfoxide (DMSO) as the organic solvent. The GPE boasts a structure free from leakage, showcases captivating ionic conductivity and thermal stability. Comprehensive structural and thermal analyses, including Fourier Transform Infrared spectroscopy (FTIR), Differential Scanning Calorimeter (DSC), and Thermogravimetric Analysis (TGA) have been carried out. The electrochemical properties of the GPE were also studied via Electrical Impedance Spectroscopy (EIS) and are significantly enhanced with higher concentration of KI introduced into the GPE. The highest ionic conductivity (σ) value of 9.76 × 10−3 S cm−1 is obtained in the GPE contained 40 wt% KI, with an efficiency of 5.65 %. Importantly, this study introduces a better and effective approach for designing electrolyte materials with high ionic conductivity, efficiency, and stability in DSSC.

A Bi2Te3 topological insulator/carbon nanotubes hybrid composites as a new counter electrode material for DSSC and NIR photodetector application

Two-dimensional layered bismuth telluride (Bi2Te3), a prominent topological insulator, has garnered global scientific attention for its unique properties and potential applications in optoelectronics and electrochemical devices. Notably, there is a growing emphasis on improving photon-to-electron conversion efficiency in dye-sensitized solar cells (DSSCs), prompting the exploration of alternatives to noble metal catalysts like platinum (Pt). This study presents the synthesis of Bi2Te3 and its hybrid nanostructure with single-wall carbon nanotubes (SWCNT) via a straightforward hydrothermal process. The research unveils a novel application for the Bi2Te3-SWCNT hybrid structure, serving as a counter electrode in platinum-free DSSCs, facilitating the conversion of triiodide (I3−) to iodide (I−) and functioning as an active electrode material in a photodetector (n-Bi2Te3-SWCNT/p-Si). The resulting DSSC employing the Bi2Te3-SWCNT hybrid counter electrode achieves a power conversion efficiency (PCE) of 4.2 %, a photocurrent density of 10.5 mA/cm2, a fill factor (FF) of 62 %, and superior charge transfer kinetics compared to pristine Bi2Te3 based counter electrode (PCE 2.1 %, FF 34 %). Additionally, a spin coating technique enhances the performance of the n-Bi2Te3-SWCNT/p-Si photodetector, yielding a responsivity of 2.2 AW−1, detectivity of 1.2 × 10−3 and enhanced external quantum efficiency. These findings demonstrate that the newly developed Bi2Te3-SWCNT heterostructure enhances interfacial charge transport, electrocatalytic performance in DSSCs, and overall photodetector performance.

Efficient and Stable Z907-Based Dye-Sensitized Solar Cells Enabled by Suppressed Charge Recombination and Photocatalytic Activity

Efficient and Stable Z907-Based Dye-Sensitized Solar Cells Enabled by Suppressed Charge Recombination and Photocatalytic Activity

Surface Loading Dictates Triplet Production via Singlet Fission in Anthradithiophene Sensitized TiO2 Films.

Singlet fission, the process of transforming a singlet excited state into two lower energy triplet excited states, is a promising strategy for improving the efficiency of dye-sensitized solar cells. The difficulty in utilizing singlet fission molecules in this architecture is understanding and controlling the orientation of dyes on mesoporous metal oxide surfaces to maximize triplet production and minimize detrimental deactivation pathways, such as electron injection from the singlet or excimer formation. Here, we varied the concentration of loading solutions of two anthradithiophene dyes derivatized with either one or two carboxylic acid groups for binding to a metal oxide surface and studied their photophysics using ultrafast transient absorption spectroscopy. For the single carboxylic acid case, an increase in dye surface coverage led to an increase in apparent triplet excited-state growth via singlet fission, while the same increase in coverage with two carboxylic acids did not. This study represents a step toward controlling the interactions between molecules at mesoporous interfaces.

Improved Interfacial Electron Dynamics with Block Poly(4-vinylpyridine)-Poly(styrene) Polymers for Efficient and Long-Lasting Dye-Sensitized Solar Cells.

Dye-sensitized solar cells (DSSCs) have recently entered the market for indoor photovoltaics. Fast electron injection from dye to titania, the lifetime of the excited dye, and the suppression of back electron recombination at the photoanode/electrolyte interface are crucial for a high photocurrent conversion efficiency (PCE). This study presents block copolymers of poly(4-vinylpyridine) and poly(styrene)-P4VP67-b-PSt x(x=23;61) as efficient accelerators of electron injection from dye to titania with extended lifetime excited states and long-lasting back electron recombination suppression. P4VP67-b-PSt23 and P4VP67-b-PSt61 rendered devices with PCEs of 10.0 and 9.8%, respectively, under AM 1.5G light; PCEs of 19.4 and 16.4% under 1000 lx LED light were attained. Copolymers provided a stable PCE with the two most popular I3 -/3I- electrolytes based on ACN and 3-methoxypropionitrile solvents; PCE history was tracked in the dark and under 1000 h of continuous light soaking with passive load according to ISOS-D1 and ISOS-L2 aging protocols, respectively. The impact of the polymer molecular structure on electron recombination, charge injection, dye anchoring, light absorption, photocurrent generation, and PCE and the long-term history of photovoltaic metrics are discussed.

Cyanoacetamide co-sensitizers DY-1 and DY-2: Unveiling a promising path to highly efficient photovoltaic devices

This paper presents a novel approach for enhancing the efficiency of dye-sensitized solar cells (DSSCs) through the co-sensitization of cyanoacetamide-based dyes DY-1 and DY-2 with N3 dye. The synthesis and characterization of DY-1 and DY-2 co-sensitizers are described and their potential applications in photovoltaic devices are investigated. The absorption properties of DY-1 and DY-2 were analyzed, revealing their efficient light absorption in the visible range. The co-sensitization of DY-1-2 with N3 dye demonstrated a significant enhancement in photovoltaic efficiency, ranging from 7.40 % to 7.92 %. The reasons for this efficiency enhancement were thoroughly analyzed and attributed to several factors. First, the combination of DY-1-2 with the N3 dye led to a broader light absorption spectrum, enabling more efficient utilization of incident photons. Additionally, co-sensitization facilitates efficient charge separation and injection processes, contributing to improved photocurrent. The acid-base co-sensitization approach further enhances the overall efficiency by maximizing the charge transfer and coverage on the semiconductor surface. This study sheds light on the development of novel sensitizers to enhance the performance of DSSCs, and the findings contribute to the advancement of photovoltaic devices.

Photophysical Properties and Photovoltaic Performance of Sensitizers with a Bipyrimidine Acceptor

Molecular engineering is a crucial strategy for improving the photovoltaic performance of dye-sensitized solar cells (DSSCs). Despite the common use of the donor–π bridge–acceptor architecture in designing sensitizers, the underlying structure–performance relationship remains not fully understood. In this study, we synthesized and characterized three sensitizers: MOTP-Pyc, MOS2P-Pyc, and MOTS2P-Pyc, all featuring a bipyrimidine acceptor. Absorption spectra, cyclic voltammetry, and transient photoluminescence spectra reveal a photo-induced electron transfer (PET) process in the excited sensitizers. Electron spin resonance spectroscopy confirmed the presence of charge-separated states. The varying donor and π-bridge structures among the three sensitizers led to differences in their conjugation effect, influencing light absorption abilities and PET processes and ultimately impacting the photovoltaic performance. Among the synthesized sensitizers, MOTP-Pyc demonstrated a DSSC efficiency of 3.04%. Introducing an additional thienothiophene block into the π-bridge improved the DSSC efficiency to 4.47% for MOTS2P-Pyc. Conversely, replacing the phenyl group with a thienothiophene block reduced DSSC efficiency to 2.14% for MOS2P-Pyc. Given the proton-accepting ability of the bipyrimidine module, we treated the dye-sensitized TiO2 photoanodes with hydroiodic acid (HI), significantly broadening the light absorption range. This treatment greatly enhanced the short-circuit current density of DSSCs owing to the enhanced electron-withdrawing ability of the acceptor. Consequently, the HI-treated MOTS2P-Pyc-based DSSCs achieved the highest power conversion efficiency of 7.12%, comparable to that of the N719 dye at 7.09%. This work reveals the positive role of bipyrimidine in the design of organic sensitizers for DSSC applications.

Enhanced efficiency and stability of dye-sensitized solar cells utilizing FeCo2S4 nanowires as Pt-free counter electrodes

Replacing traditional Pt-based counter electrodes with low-cost and highly stable materials is crucial for the development of commercially viable dye-sensitized solar cells (DSSCs). In this study, we synthesized a ternary Pt-free FeCo2S4 nanowire (NW)-based sulfide electrocatalyst by a three-step solvothermal method. This material was then used as a counter electrode in DSSCs to facilitate the reduction of triiodide species. The formation of FeCo2S4 NW was confirmed by various characterization techniques such as X-ray diffraction, energy dispersive X-ray spectroscopy and X-ray photoelectron spectroscopy. Scanning electron microscopy analysis revealed the structure of the nanowires. Electrochemical studies, which included cyclic voltammetry, electrochemical impedance spectroscopy and Tafel polarization methods, revealed the excellent stability, superior electrocatalytic activity and remarkable kinetics of FeCo2S4 NW in the reduction of triiodide to iodide. Photovoltaic measurements of the fabricated DSSCs yielded a power conversion efficiency (PCE) of 7.88 % for the FeCo2S4-based devices, outperforming the control device made of Pt (PCE=7.45 %). This improvement was primarily due to the increase in short-circuit current density (JSC), thanks to the lower charge transfer resistance (RCT) of FeCo2S4 NW (JSC=15.23 mA/cm2; RCT=5.54 Ω cm2) compared to Pt (JSC=14.12 mA/cm2; RCT=7.07 Ω cm2). In addition, the FeCo2S4 NW-based solar cells exhibited excellent stability and maintained their high PCE value even after 10 days of aging under ambient conditions, while Pt-based DSSCs showed a 3 % decrease from their initial PCE value. This FeCo2S4 NW counter electrode proves to be an excellent alternative to Pt, and the presented results provide valuable insights for the development of cost-effective and highly stable DSSCs.

Carbon dots-Zno/TiO2 ternary nanocomposite as a proficient material to enhance the performance of natural DSSC

A novel sustainable approach for enhancing the efficiency of dye-sensitized solar cells (DSSCs) involves the utilization of a combination of ZnO and carbon dots (CDs) derived from Citrus medica fruit extract, along with microwave-synthesized TiO2 nanoparticles for the preparation of the photoanode. Natural dyes such as Hibiscus rosa-sinensis and Allium Cepa peel are employed as sensitizers to reduce production costs. This co-activation method has demonstrated a significant improvement in the output parameters of the devices. Notably, the photoanode co-activated with ZnO-CD composite (ZnO-CD/TiO2) exhibits the most favorable output parameters when combined with Hibiscus rosa-sinensis dye (open circuit voltage (Voc) = 0.80 V, short circuit current density (Jsc) = 6.62 mA/cm2, fill factor (FF) = 64.20 %, photo conversion efficiency (PCE) = 3.40 %) and Allium Cepa peel dye (Voc = 0.81 V, Jsc = 6.79 mA/cm2, FF = 65.70 %, PCE = 3.61 %). When paired with Allium Cepa dye, the CD modified photoanode (CD/TiO2) offers Voc = 0.73 V, Jsc = 6.64 mA/cm2, FF = 61.27 % and PCE = 2.97 %. Similarly, when combined with Hibiscus rosa-sinensis dye, the output parameters of the CD/TiO2 photoanode are Voc = 0.72 V, Jsc = 6.54 mA/cm2, FF = 64.4 % and PCE = 3.03 %. In comparison to all tested devices, the unmodified photoanode (TiO2) displayed the lowest performance, with parameters such as Voc = 0.59 V, Jsc = 6.45 mA/cm2, FF = 52.5 %, PCE = 2.10 % using Allium Cepa peel dye, and Voc = 0.66 V, Jsc = 6 mA/cm2, FF = 51.60 %, PCE = 2.04 % using Hibiscus rosa-sinensis dye. Furthermore, the co-activation process has been shown to enhance the stability of the devices. While the unmodified photoanodes ceased to operate after eight days, the ZnO-CD composite co-activated photoanodes retained their initial efficiencies up to 61.50 % and 68.53 % with the Allium Cepa peel dye and Hibiscus rosa-sinensis dye, respectively. Therefore, this study underscores the potential of the synthesized composite material in enhancing the performance of natural DSSCs.

Investigation of using amine and acetylamine functional units on naphthalimide dyes for photovoltaic devices

Purpose The purpose of this paper is to introduce four new organic dyes based on naphthalimide for dye-sensitized solar cells (DSSCs). Design/methodology/approach Four new dyes based on naphthalimide with substitutions of amine and acetylamine in position C4 were designed in conjugation with substituted carbazole as donor–acceptor (D-A) architecture. The absorption and emission characteristics of the prepared dyes were evaluated in H2O, DMF and their mixture (DMF:H2O = 1:1). The feasibility of electron transfer in the DSSCs structure and energy levels were evaluated using electrochemical and density functional theory, which confirm the use of dyes in the DSSCs structure. The DSSCs were prepared using an individual strategy and their optical properties were investigated under the light of AM 1.5. Findings The prepared dyes exhibit orange color with strong emission at λem = 530–570 nm due to charge transfer with a positive solvatochromic effect. The efficiency of DSSCs based on Dye1-4 1 is: 3.69%, 3.71%, 4.69% and 4.76%. Therefore, the power efficiency increases by about 29 % in the presence of acetylamine group. Practical implications The design of new structures of organic dyes should be accompanied by the development of optical and electrical properties. In other words, in addition to the continuous production of electrons, efficient dyes must also be resistant to light to increase the life of the device. Social implications Organic dyes play a key role in the production of electrons in the DSSCs structure. The engineering of these structures and the introduction of widely used but low cost types can play an important role in the development of clean energy production. Originality/value The application of organic dyes based on naphthalimide was evaluated in the DSSCs structure and its photovoltaic properties were investigated.

Molecular Engineering Strategies of Spectral Matching and Structure Optimization for Efficient Metal-Free Organic Dyes in Dye-Sensitized Solar Cells: A Theoretical Study.

Metal-free organic dyes are promising dyes that can be applied widely in dye-sensitized solar cells (DSSCs). The rational design and selection of dyes with complementary absorption can promote the development of methods that can enhance the utilization of incident light by DSSCs, such as cosensitization and tandem devices. Based on these opinions, the structure of the reported high-performance metal-free organic dye ZL003 is used as a template to design two new metal-free organic dyes, HX-1 and HX-2, by replacing its donor unit with a 2-phenothiazine-phenylamine unit and fusing its three independent π-bridge units into a whole with the aim of driving the red shift and the blue shift of the absorption spectra of ZL003, respectively. Through theoretical investigation, it is demonstrated that the perfect complementary optical absorption of HX-1 and HX-2 can be realized as the shift of the absorption spectra of ZL003 to different directions, which means their feasibility to the application in cosensitization or tandem dye-sensitized solar cells (T-DSSCs). Furthermore, it is hypothesized that HX-1 may be the dye with better photovoltaic performance than ZL003 by modeling their intramolecular charge-transfer (ICT) processes, TiO2 surface adsorption, and photovoltaic parameters. The short-circuit current density (Jsc) and photoelectric conversion efficiency (PCE) of HX-1 are 23.10 mA·cm-2 and 21.26% in theory, compared to those of 20.68 mA·cm-2 and 19.64% in ZL003 at the same computational level, respectively. In view of the complementary optical properties, the combination of HX-1 with HX-2 may be a reasonable option for dyes for the development of a highly efficient cosensitization system or T-DSSCs in the future. In terms of such findings, these two novel metal-free organic dyes may have bright prospects in the research of highly efficient DSSCs, and this work can provide a reference for the design of dyes with complementary absorption through simple structural adjustments of the realistic dyes with high photovoltaic performance.

The influence of metal-free thiophene spacer chain on optoelectronic analysis by TD-DFT method for efficient dye-sensitized solar cells with enhanced non-linear optical activity

The pyrene group in conjugation with the thiophene moiety was used to design new organic molecules for the dye-sensitized solar cells (DSSCs) along with non-linear optical (NLO) properties. Five new thiophene chain conjugation molecules (PTRA-SPn, n = 1–5) were formed based on the (E)-2-(5-oxo-4-((5-(pyren-1-yl)thiophen-2-yl)methylene)-2-thioxothiazolidin-3-yl)acetic acid (PTRA). To comprehend the function of conjugation in varying the optoelectronic characteristics of these compounds, the π-spacer chain has been screened. The techniques of density functional theory (DFT) and time-dependent DFT (TD-DFT) have been used to study the electronic structures, Ultraviolet–Visible (UV–Vis) absorptions, and NLO activities of donor-spacer-acceptor (D-π-A) structures. According to the computed results, PTRA-SP5 exhibits a smaller energy gap (Eg) of 2.11 eV. The maximum UV–Vis spectrum has been found in PTRA-SP5 with a wavelength (λmax) of 532 nm. The reorganizational energy (RE) and dye regeneration (ΔGreg) of PTRA-SP5 are the smallest (λ- = 0.2340 eV, λ+ = 0.2122 eV, ΔGreg = 0.21 eV) compared to other sensitizers. The lowest exciton binding energies (Eb) of PTRA-SP2 (0.06 eV) and PTRA-SP3 (0.06 eV) are the lowest ones. The open circuit photovoltage (eVoc) for PTRA-SP5 (1.10 eV) is the highest. The NLO activity of the dipole moment (μnormal) and first-order hyperpolarizability (β) values of PTRA-SP5 achieve higher values (9.00 Debye and 34.82 × 10−30 esu, respectively). In summary, this work refined the impact of chain π-linkers on the photophysical characteristics of D-π-A spacer derivatives and offered some helpful suggestions to create new organic materials for optoelectronic uses.

Synergistic nanoarchitecture of polythiophene/graphene for enhanced efficiency in dye-sensitized solar cells

In the present study, nanocomposites composed of graphene and polythiophene (PTh) were synthesized through in-situ polymerization techniques. The morphological properties of the composites and the interactions among their constituents were examined utilizing X-ray Diffraction and Scanning Electron Microscopy. The findings suggest that the concentration of graphene within the composites exerts an influence on the performance of solar devices. The solar cell employing a 15% graphene/PTh composite demonstrated superior efficiency at 8.82% compared to its counterparts utilizing 10% (6.62%) and 20% (7.53%) graphene/PTh composites. Furthermore, the efficiency of the graphene/PTh device (8.82%) surpassed that of a platinum (Pt)-based solar cell (8.06%). Thus, graphene/PTh composites exhibit the potential to replace platinum and pave the way for the commercialization of DSSCs.