Electron-hole Recombination Rate Research Articles

Exploring Pt-Impregnated CdS/TiO2 Heterostructures for CO2 Photoreduction

This work focuses on the production of methane through the photocatalytic reduction of carbon dioxide using Pt-doped CdS/TiO2 heterostructures. The photocatalysts were prepared using P25 commercial titania and CdS synthesized through a solvothermal methodology, followed by the impregnation of Pt onto the surface to enhance the physicochemical properties of the resulting photocatalysts. The pure and heterostructure-based materials were characterized using X-ray diffraction (XRD), inductively coupled plasma optical emission spectroscopy (ICP-OES), scanning electron microscopy (SEM) with energy dispersive X-ray spectroscopy (EDX), transmission electron microscopy (TEM), X-ray photoelectron spectroscopy (XPS), ultraviolet-visible spectroscopy (UV-Vis), ultraviolet photoelectron spectroscopy (UPS), and photoluminescence spectroscopy (PL). The obtained results show the successful synthesis of the heterostructure impregnated with Pt. Moreover, the observed key role of CdS and Pt nanoparticles in the final semiconductor is to reduce the electron-hole pair recombination rate by acting as an electron sink, which slows down the recombination process and increases the photocatalyst efficiency. Thus, Pt-doped CdS/TiO2 heterostructures with the best observed composition presents better catalytic activity than P25 titania with methane production values being 460 and 397 µmol CH4/g·h, respectively.

Designed of dual direct band gap graphdiyne/Co2VO4 S-scheme heterojunction: Enhance the bonding stability of Co active sites to promote photocatalytic hydrogen evolution

The selection of direct band gap semiconductors with high-efficiency electron transitions and the rational adjustment of the d-band center of transition metal atoms can effectively enhance photocatalytic hydrogen evolution. Based on this premise, the double direct band gap graphdiyne/Co2VO4 S-scheme heterojunction was designed via an immersion method. DFT calculation, in-situ XPS and EPR analysis not only provided support for the formation of graphdiyne /Co2VO4 S-scheme heterojunction but also demonstrated that Co maybe served as the most efficient active site for hydrogen evolution. Furthermore, the design of S-scheme heterojunction effectively prolongs the carrier lifetime of the photocatalyst, resolves the deficiency in high electron-hole pair recombination rate of direct band gap semiconductors, and maintains its efficient electronic transition. PDOS analysis revealed that the interaction between graphdiyne and Co2VO4 at the microscopic interface tends to modulate the d-band center of cobalt atoms, resulting in a decrease in electron occupation on antibonding orbitals and consequently enhancing bonding stability at Co active sites. Moreover, introducing graphdiyne effectively increases electron state density near the Fermi level of Co2VO4, facilitating rapid migration of photogenerated charges. This study provides valuable insights into the regulating d-band centers of transition metal and the development of double direct band-gap S- scheme heterojunctions.

Breaking New Grounds: solid-state synthesis of TiO2 – La2O3 – CuO Nanocomposites for degrading Brilliant Green dye under Visible Light

Environmental pollution, particularly from industrial dyes and chemicals, poses a significant threat to ecosystems and human health. Traditional pollution mitigation methods are often inefficient and costly. Photocatalysis has emerged as a promising solution for degrading pollutants using light energy. Titanium dioxide (TiO2) is a widely studied photocatalyst due to its stability, non-toxicity, and strong oxidative power. However, its efficiency is limited by a wide bandgap, restricting absorption to the UV region, and rapid electron-hole recombination. To address these limitations, doping TiO2 with materials like La2O3 and CuO has been explored to enhance its photocatalytic activity under visible light. This study investigates the enhancement of TiO2 nanocomposites by incorporating La2O3 and CuO. X-ray diffraction (XRD) revealed that the nanocomposites retained TiO2's anatase and rutile phases with improved crystallinity. Scanning electron microscopy (SEM) displayed spherical nanoparticles forming agglomerates, typically due to high surface energy. Energy-dispersive X-ray spectroscopy (EDS) and X-ray photoelectron spectroscopy (XPS) confirmed the presence of La and Cu in the TiO2 matrix. Fourier-transform infrared (FTIR) spectroscopy identified characteristic vibrational modes of Ti–O, La–O, and Cu–O bonds, suggesting strong chemical interactions between dopants and TiO2 lattice. Ultraviolet-visible (UV-Vis) spectroscopy showed a red shift in absorption spectra with La2O3 and CuO addition, reducing the bandgap energy from 3.23 eV (pure TiO2) to 2.27 eV for the TiO2–0.1La2O3–0.2CuO composite. Photoluminescence (PL) spectroscopy indicated improved charge separation and reduced electron-hole recombination rates in the synthesized nanocomposites. Photocatalytic performance was evaluated by degrading Brilliant Green (BG) dye under visible light. The TiO2–0.1La2O3–0.2CuO (TLC0.2) nanocomposite achieved a maximum dye degradation of over 95% after 204 minutes under optimal conditions (C0 = 17 mg/L and a S/L ratio of 1 g/L). Adding the inorganic agent Na2SO4 to this process significantly enhanced photocatalytic activity, increasing degradation from 56% to 95% after 180 min of visible light irradiation under C0 = 20 mg/L and S/L = 0.5 g/L conditions, as it shows a high stability after six reuse cycles. In conclusion, La2O3 and CuO doping significantly enhance TiO2 nanocomposites' crystalline structure, morphology, optical properties, and photocatalytic efficiency, demonstrating their potential for environmental remediation and solar energy conversion.

Modification of opto‐electrical behavior of polyvinyl chloride by infusion of SrTiO3 nanofiller synthesized via green route

AbstractEnhancing the opto‐electrical properties of polymer is crucial for optoelectronic devices. This study emphasis the synthesis of strontium titanate (SrTiO3) nanoparticles using a green sol–gel method and incorporates them into polyvinyl chloride (PVC) to create nanocomposite films via solution casting. The structural, optical, thermal, and electrical properties of PVC with SrTiO3 at concentrations of 1, 3, and 5 wt.% were examined. Better crystallinity was obtained with filler incorporation. Fourier transform infrared shows the physical interaction between nanofiller and the matrix. SEM results suggested that SrTiO3 nanofiller are well distributed in PVC surface. UV–Vis spectroscopy was used to study optical behavior of the nanocomposites. Optical bandgap energy decreased from 3.2 to 2.5 eV with increased concentration of SrTiO3 in PVC matrix. Photoluminescence results show the reduction of electron hole recombination rate. The integration of SrTiO3 nanofiller into the PVC matrix improved the thermal stability, dielectric constant, and the overall performance of the prepared nanocomposite films, making them suitable for high‐temperature optoelectronic and energy storage applications. The green synthesis of SrTiO3 nanofiller also ensures the environmental benefits, high purity, and homogeneity, leading to consistent enhancements in the PVC/SrTiO3 composites. These improvements highlight their potential for advanced optoelectronic devices requiring efficient and durable materials.

Exploring the photocatalytic breakdown of organic pollutants using intercalated ZnO/SiO2 nanocomposites

The increasing prevalence of organic pollutants in water sources necessitates the development of efficient and cost-effective photocatalysts for their degradation. ZnO nanoparticles (NPs) have been widely studied for their photocatalytic properties; however, their application is hindered by low photocatalytic efficiency and high recombination rates of photogenerated carriers. This manuscript explores the enhanced photocatalytic performance of intercalated ZnO/SiO2 nanocomposites (NCs), synthesized through a combination of co-precipitation and Stöber methods, as a solution to these challenges. A comprehensive analysis of the structural, optical elemental and Morphological properties of both ZnO NPs and ZnO/SiO2 NCs was conducted using various characterization techniques, including X-ray diffraction (XRD), high-resolution transmission electron microscopy (HRTEM), X-ray photoelectron spectroscopy (XPS), UV–Vis spectrometry and Brunauer-Emmett-Teller (BET) analysis. Through, XRD analysis, the calculated crystallite sizes of ZnO NPs and ZnO/SiO₂ NCs were found to be 36 nm and 39 nm respectively. TEM images illustrated that the ZnO NPs and ZnO/SiO₂ NCs have crystallized in elongated spherical morphology. XPS and FTIR analyses provided the signature band details the presence of Cu and Si in their Zn2⁺ and Si⁴⁺ oxidation states. The optical bandgap energies were calculated to be 3.38 eV for ZnO NPs and 3.22 eV for ZnO/SiO₂ NCs. The enhanced photocatalytic efficiency of the ZnO/SiO2 NCs achieved an impressive degradation rate of 92 % for Rhodamine B (RhB), compared to a relatively lower rate of 81 % for pure ZnO NPs for the degradation of RhB under visible light due to its lower bandgap, high surface area, and lower electron-hole recombination rate. BET surface area measurements revealed that ZnO nanoparticles have a surface area of 11.234 m2/g, while ZnO/SiO₂ NCs show 57.118 m2/g, highlighting SiO₂'s enhancement. The NCs demonstrated exceptional reusability for degradation, sustaining high efficiency across multiple cycles. Its ability to scavenge superoxide radicals highlighted the effectiveness of the ZnO/SiO₂ NCs in environmental remediation, especially for wastewater treatment.

Sonochemical preparation of powerful S-scheme Zr(HPO4)2/g-C3N4 heterojunction for photocatalytic degradation of rhodamine B under natural solar radiations

An effective Zr(HPO4)2/g-C3N4 S-scheme heterojunction was synthesized by sonochemical coupling of Zr(HPO4)2 nanoparticles as an oxidative photocatalyst [EVB = +3.0 eV] with g-C3N4 nanosheets as an effective reductive photocatalyst [ECB = −1.25 eV] for photocatalytic degradation of rhodamine B dye under natural solar radiation of 1000 W power. The physicochemical properties of the as-synthesized heterojunctions were investigated by X-ray diffraction [XRD], N2-adsorption-desorption isotherm, diffuse reflectance spectrum [DRS], photoluminescence [PL], scanning electron microscope [SEM], X-ray photoelectron spectroscope [XPS], and high resolution transmission electron microscope [HRTEM]. The experimental results implied the agglomeration of Zr(HPO4)2 nanoparticles on g-C3N4 sheets which reduced the specific surface area of the solid specimen from 88 to 21 m2/g. The significant increase in the photocatalytic degradation rate of RhB dye with introducing Zr(HPO4)2 nanoparticles implied that Zr(HPO4)2 plays a crucial role in reducing the band gap energy and remarkable increasing in the rate of electron-hole separation. The photocatalytic experiments implied that incorporation of 5 wt% Zr(HPO4)2 on g-C3N4 sheets destroyed 98 % of RhB dye during 3 h of light illumination with pseudo-first-order rate of 0.048 min−1. The remarkable enhancement in the photocatalytic performance of Zr(HPO4)2/g-C3N4 heterojunctions was ascribed to successful generation of an effective S-scheme heterojunction with strong redox power, utilizing of both hydroxyl and superoxide radicals in the degradation process and limiting the electron-hole recombination rate. Based on scavenger experiments and terephthalic acid PL analysis, the S-scheme pathway was chosen as the proposed mechanism for photocatalytic charge transfer. The as-synthesized Zr(HPO4)2/g-C3N4 heterojunction with exceptional redox power is considered a novel candidate for destructing organic pollutants that exist in industrial wastewater.

Development and Performance of a PANI@NiMnO3 Nanocomposite for Enhanced Supercapacitors and Photocatalytic Applications.

Conductive polymers are gaining considerable attention as a potential material for supercapacitor electrodes due to their favorable properties. Among these, polyaniline (PANI) stands out as a cost-effective and easy to synthesize, making it a promising candidate for improving energy storage applications. This study presents the synthesis of a hybrid composite consisting of PANI and NiMnO3 (NMO) perovskite using the chemical oxidative polymerization method. The morphology and structure of the composite were analyzed by using scanning electron microscopy (SEM) and X-ray diffraction (XRD), respectively. XRD results showed that the addition of NMO transformed the amorphous structure of PANI into a semicrystalline form, leading to enhanced conductivity. SEM images revealed a more uniform and compact structure, with NMO distributed unevenly within the polymer matrix. Optical analysis indicated that a reduction in the band gap of PANI@NMO reached 2.5 eV. N2 adsorption-desorption measurements confirmed an increase in the surface area and pore volume. The photocatalytic activity of the PANI@NMO nanocomposite was tested by degrading methylene blue (MB) dye under UV/visible light. The nanocomposite showed high efficiency, degrading 87.75% of MB dye after 125 min of irradiation as compared to their counter parts. Additionally, electrochemical tests demonstrated an improved electrochemical performance of the composite due to enhanced crystallinity, increased surface area, and reduced electron-hole recombination rate. These results suggest that the PANI@NMO nanocomposite has great potential for use in supercapacitors and photocatalysis.

Structural, optical, photocatalytic and thermal behaviour of (Nb, Ta) co-doped WO3 nanoparticles and its application in photocatalytic degradation of MG and RhB dyes

In this communication, eco-friendly, cost effective and facile hydrothermal route was adopted to synthesize pure WO3, Nb-doped WO3 and (Nb, Ta) co-doped WO3 nanoparticles. Phase, lattice constants, crystallite size and crystallinity have been evaluated through X-ray diffraction. The insertion of Nb and Ta ions into WO3 nanoparticles was confirmed by XPS, FTIR and EDS studies. HRTEM and SAED micrographs exhibited highly nanocrystalline nature of samples. UV–visible studies was carried out to analyse nature of band gap, band gap energy, extinction coefficient, refractive index, Urbach energy and optical conductivity of prepared samples. Optical band gap was narrowed from 2.94 to 2.49 eV and Urbach energy was extended from 0.08 to 0.35 eV through co-doping of (Nb, Ta) ions into WO3 NPs. Reduction in PL intensity revealed that electron-hole pair recombination rate was decreased with co-doping of (Nb, Ta) ions. The photo-degradation efficiency of (Nb 5 %, Ta 5 %) co-doped WO3 nanophotocatalysts was 93.12 % against MG and 90.11 % against RhB dyes. The rate constant was found to be increased from 0.0107 to 0.0203 min−1 for MG and 0.0086 to 0.0174 min−1 for RhB. Thermal results exhibited the weight loss in three phase degradation processes, and thermal stability. The results showed that (Nb 5 %, Ta 5 %) co-doped WO3 NPs is a potential candidate for practical applications in environmental remediation (organic dyes degradation).

In-Situ Construction of Atomic-Level Fe-O Bond Bridges within Fe2N/g-C3N4 Heterojunction for Efficient Visible-Light-Driven Photocatalytic H2 Production.

The limited active sites and faster photogenerated electron-hole pair recombination rate of g-C3N4 restrict its application in photocatalytic H2 production. Constructing heterojunctions has been shown to improve the spatial (directional) separation of photogenerated electrons and holes. However, due to interface mismatch in traditional heterojunction structures and a lack of precise electron transport channels, the photocatalytic efficiency is limited. Here, we developed a two-step calcination approach to create an Fe2N/g-C3N4 heterojunction linked by Fe-O bonds (named as Fe-OCN). The newly formed Fe-O bonds within the heterojunction can act as atomic-level interface electron transfer channels, directly transferring the photogenerated electrons of g-C3N4 to the reactive center Fe2N, significantly improving the charge transfer rate and utilization, thus promoting visible-light-driven photocatalytic H2 production. The optimal Fe-OCN achieved a H2 production rate of 5986.29 μmol g-1 h-1 under visible light, 13.44 times higher than that of the OCN due to efficient charge separation and transfer capabilities. This work provides a constructive reference for the design and synthesis of organic-inorganic heterojunction with chemically bonded interfaces, establishing quick electron transfer channels, and achieving targeted electron transfer.

Fabrication of efficient interface carrier channels on multidimensional O[sbnd]CQD Decorated CN Heterojunction for tetracycline degradation via peroxymonosulfate activation

Graphite carbon nitride (CN) is recognized as a promising non-metallic semiconductor photocatalyst for its excellent chemical stability and visible light response. However, the high electron-hole recombination rate in CN greatly limits its photocatalytic performance. To circumvent these limitations, it is particularly important to explore an efficient way to promote the migration of carriers in CN. This study innovatively designs a multidimensional heterojunction between organic carbon quantum (OCQD) and CN, which named as OCQD-CN. OCQD acts as an carriers transfer channel, which effectively promotes the separation efficiency of carriers. Meanwhile, the introduction of OCQD further improves light absorption scope as well as light reaction intensity of CN. By adding peroxymonosulfate (PMS) to form an advanced oxidation process, OCQD-CN10 exhibits a prominent tetracycline (TC) degradation capacity up to 89.1 % within 60 min. The photocatalytic degradation performance of OCQD-CN is significantly improved by 2.0 times with the addition of OCQD. The first-order rate constant corresponding of OCQD-CN10 (0.0300 min−1) is also 2.8 times higher than CN (0.0107 min−1). Thereby, this research underscores the potential of OCQD-CN/PMS system in mitigating water pollution and advancing eco-friendly technologies, offering a promising route to address antibiotic contaminants in the environment.

Nickel-doped and surface fluorinated tungsten trioxide photoanode with enhanced photoelectrochemical water oxidation

To improve the slow charge transfer and high electron-hole recombination rate of tungsten trioxide (WO3), a nickel-doped and surface fluorinated WO3 photoanode is proposed. Compared with the unmodified and one-step modified WO3 photoanodes, the co-modified F/Ni-WO3 with two steps exhibits superior photoelectrochemical (PEC) performance with a significantly high photocurrent density of 1.03 mA/cm2 compared to 0.51 mA/cm2 of bare WO3 at 1.23 V vs. RHE. Ni doping can accelerate the kinetics of water oxidation and extend the light absorption range of the WO3 photoanode, while surface fluorination can enhance the surface electronegativity and hydrophilicity of the WO3 photoanode. The synergistic influence of the Ni doping and surface fluorination results in a lower carrier transport impedance, higher charge separation efficiency and larger electrochemically active surface of the WO3 photoanode which eventually contribute to the enhanced PEC performance for water oxidation.

Visible light-induced continuous process for photodegradation of chlorpyrifos using g-C3N4/GO/La2O3 photocatalyst from agricultural aquatic waste

The widespread use of pesticides and the formation of by-products on the gradual decomposition of these pesticides have led to environmental pollution, which in turn has caused harm to both human and ecosystem health. Pesticides have been found in water bodies worldwide and are a cause of concern. Photocatalytic reactions have received significant attention in the past few decades for the breakdown of pesticides. Different parameters were studied, including the effects of pH, kinetics, dose, and regeneration. The UV–vis spectroscopy results suggest that the g-C3N4/GO/La2O3 nanocomposite is a superior reusable photocatalyst for the degradation of chlorpyrifos (CPF) compared to pure g-C3N4 and GO/ g-C3N4. This is demonstrated by the fact that the g-C3N4/GO/La2O3 nanocomposite outperforms both of these materials. The increased photocatalytic performance may be attributed to a balance between the band gap, morphology, crystalline quality, and surface area, all of which may be slowing down the electron-hole recombination rates. This may be due to the enhanced photocatalytic performance. In addition, the feasible processes were outlined from radical quenching studies, and the results clearly indicate that the presence of more OH radicals plays an essential role in the process of efficient photodegradation using novel g-C3N4/GO/La2O3 nanocomposites.

Holmium doped La2O3 and its Composite with Graphitic Carbon Nitride for the Removal of Atrazine and Chlorpyrifos from Wastewater

Herein, the co-precipitation method was employed for the synthesis of rare earth metal oxide La2O3, Holmium doped La2O3, and its composite with 2D layered material i.e. graphitic carbon nitride (g-C3N4) to study their photocatalytic behavior towards organic pollutants. Pollutants employed to study are pesticides that include atrazine and chlorpyrifos. Structural, spectral, morphological, and elemental analysis were done by XRD, FTIR, SEM, and EDX respectively. Optical bandgap calculations showed the decrease in band edge positions of the bare La2O3 from 5.02eV to 3.39eV by doping of Ho in La2O3 lattice. The photocatalytic degradation efficiency of prepared samples was evaluated using a dual beam UV-Visible spectrophotometer. Experimental investigation showed that the prepared composite i.e. Ho doped La2O3@g-CN had remarkable photodegradation activity of about 60% and 86% towards the atrazine and chlorpyrifos respectively. While the pristine La2O3 showed only 41% and 65% degradation activity and Ho doped La2O3 showed 52% and 75% removal efficiency for atrazine and chlorpyrifos respectively by using 0.03g/100mL of photocatalysts under solar light exposure of about 80min. The enhanced degradation activity of composite (g-C3N4/Ho@La2O3) as compared to its other counter parts is due to its increased surface area and more active sites provided by g-C3N4 for electrons trapping to cause a delay in electron-hole pair recombination rate. The enhanced surface area also played a key role in adsorbing more pollutant molecules for degradation.

Bismuth-based photocatalysts enhanced by sulfur/oxygen vacancies for the selective reduction of carbon dioxide into methane

Reducing carbon dioxide (CO2) into methane (CH4) through photocatalysis technology can effectively decrease carbon emissions and ease the energy crisis. However, the low photocatalytic efficiency and high electron-hole recombination rates still hinder the large-scale utilization of photocatalysis. Vacancy engineering can reduce electron-hole pair complexation, however, the effects of oxygen (O) and sulfur (S) vacancies on the CO2 reduction properties of bismuth (Bi)-based photocatalysts are unclear. This study prepared different Bi-based photocatalysts, including α-Bi2O3, α-Bi2O3-X, Bi2S3, and Bi2S3-X. The introduction of vacancies was found to greatly increase the specific surface areas, effectively reduce electron-hole recombination, decrease charge transfer resistance, and enhance electron transfer, leading to enhanced CH4 production. Comparatively, Bi2S3-X has substantially demonstrated a superior efficiency in the photocatalytic conversion of CO2 to CH4 compared to Bi2S3, while α-Bi2O3-X exhibited slightly higher than α-Bi2O3. There are more S vacancies in Bi2S3-X (x=0.581) than O vacancies in α-Bi2O3-X (x=0.329), leading to its superior photocatalytic activity, with CO and CH4 production rates of 3.706 μmol·g−1·h−1 and 7.697 μmol·g−1·h−1, respectively. Moreover, the CH4 selectivity of Bi2S3-X reaches 67.50 %, which is 1.67 times that of α-Bi2O3-X. Therefore, Bi2S3-X holds great promise as a photocatalyst for CO2 reduction. This work proves that in Bi-based photocatalyst, S vacancy is more effective than O vacancy in enhancing the selective reduction of CO2 to CH4, offering a pathway for achieving selective CO2 reduction to CH4.

Fabrication of In-doped CdSe/Zn3In2S6 type II heterojunction composite for efficient photocatalytic hydrogen evolution

Conversion of water into renewable hydrogen energy using solar energy is one of the ideal methods to address the current environmental pollution and increasing energy demand. Thus developing the photocatalyst with high efficiency, stability, and a low electron-hole recombination rate becomes very important. In this paper, Zn3In2S6 microspheres were synthesized by hydrothermal method, and then In-doped CdSe nanoparticles were loaded on the surface of Zn3In2S6 microspheres to form Cd0.9In0.1Se/Zn3In2S6 type II heterojunction. Under simulated sunlight irradiation, the photocatalytic hydrogen production of Cd0.9In0.1Se/Zn3In2S6 reached 11.41 mmol h−1 g−1, which was 4.61 times and 1.97 times that of Cd0.9In0.1Se and Zn3In2S6, respectively. The experimental results showed that the formation of type II heterojunction could improve the photocatalytic hydrogen production efficiency by shortening the charge transport distance and inhibiting the recombination of electron-hole pairs. This work will provide new ideas and insights for the development of photocatalytic hydrogen production technology.

Preparation of C@CuNi/TiO2 with a local surface plasmon resonance for photocatalytic degradation of organic dyes and antibiotics under visible light irradiation

A composite photocatalyst with carbon-coated CuNi nanoparticles-loaded TiO2 nanotubes (C@CuNi/TiO2) was synthesized via a microwave hydrothermal alkali stripping method combined with subsequent in-situ carbothermal reduction. The structure, morphology, and surface chemical composition were investigated using X-ray diffraction, scanning electron microscopy, transmission electron microscopy, and X-ray photoelectron spectroscopy. The findings demonstrate that the microwave hydrothermal alkali peeling enables the formation of a three-dimensional C@CuNi/TiO2 composite structure. The results of transient photocurrent response (i-t) and electrochemical impedance spectroscopy under visible light demonstrate that C@CuNi/TiO2 exhibits a reduced rate of electron-hole recombination and lower surface resistance compared to C@TiO2, C@Cu/TiO2, and C@Ni/TiO2. After a two-hour exposure to visible light, the composite photocatalyst C@CuNi/TiO2, featuring a molar ratio of 2 % CuNi nanoparticles to TiO2 nanotubes, exhibited remarkable degradation activity towards organic dyes (Rhodamine B (RhB), Methylene Blue (MB), Methyl Orange (MO)), as well as antibiotics (tetracycline (TC) and levofloxacin (LVFX)). After 5 cycles of photocatalytic reaction, the photodegradation activity of RhB remained above 79 %. It is indicated that CuNi nanoparticles effectively trap and enrich photoelectrons through the photoexcitation of TiO2 nanotubes. Additionally, the local surface plasmonic resonance (LSPR) effect of CuNi nanoparticles reduces the recombination rate of photogenerated electron/hole and the electron transport resistance in the composite photocatalyst, thereby enhancing its overall photocatalytic activity.

Photocatalytic water splitting and charge carrier dynamics of Janus PtSSe/ζ-phosphorene heterostructure

On the basis of first-principles calculations and non-adiabatic molecular dynamics (NAMD) simulations, we explore the photocatalytic water splitting properties of PtSSe/ζ-Phosphorene heterostructure. This heterostructure possess semiconducting nature with high carrier mobility (≈ 103 cm2V− 1s− 1). The calculated high value of electron-hole recombination rate as compared to electron transfer rate and hole transfer rate, establish the Type-II mechanism more favorable for PtSSe/ζ-Phosphorene heterostructure. Further, the calculated value of solar-to-hydrogen (STH) conversion efficiency of PtSSe/ζ-Phosphorene exceeds to 10%, which makes it the potential candidate for commercial production of hydrogen for industrial use. STH conversion efficiency is further tunable on rotating one monolayer over other with specific angles in the heterostructure. Our study demonstrates PtSSe/ζ-Phosphorene heterostructure to be efficient Type II-scheme photocatalyst for water splitting.

Synthesis and recent developments of MXene-based composites for photocatalytic hydrogen production

Abstract The energy crisis has already seriously affected the daily lives of people around the world. As a result, designing efficient catalysts for photocatalytic hydrogen evolution (PHE) is a promising strategy for energy supply. Co-catalyst modification can significantly enhance the photocatalytic activity of single semiconductors, overcoming limitations posed by their narrow visible light absorption range and high electron–hole recombination rate. MXene-based composites demonstrate immense potential as co-catalysts for photocatalytic hydrogen production owing to their distinctive two-dimensional layered structure and outstanding photoelectrochemical properties, and further research and development efforts surrounding MXene-based composites will contribute significantly to the progress of sustainable energy technologies. In this review, we offer a comprehensive overview of synthesis methods for MXene and MXene-based composites, highlight illustrative instances of binary and ternary MXene-based composites in PHE, and explore potential avenues for future research and expansion of MXene-based composites.

Structural, optoelectronic, mechanical and thermoelectric properties of ZrO2 via band engineering with Nb doping

The study investigates the structural, mechanical, optoelectronic, and thermoelectric properties of pure and doped ZrO2 using WIEN2k. The goal is to evaluate their potential contribution to future thermoelectric and photovoltaic systems. Thermodynamic stability is confirmed through molecular dynamic simulations, while mechanical stability is confirmed through mechanical features. The electronic characteristics are determined using the GGA-PBE functional. For pristine, 25 % doped, and 50 % doped ZrO2, the measured band gaps were 3.10, 2.92, and 2.73eV, respectively. Significant absorption and conductivity are found in the examined optical properties, together with decreased reflectance and optical loss, which points to a lower rate of electron-hole pair recombination. At lower temperatures, the thermoelectric properties show a noteworthy ZT. As a result, these materials may efficiently transform thermal energy into useful electrical power and offer a considerable potential for optoelectronic technology.

Facile construction of ZnWO4/g-C3N4 heterojunction for the improved photocatalytic degradation of MB, RhB and mixed dyes

This study presents the construction of binary ZnWO4/g-C3N4 nanocomposite via a facile hydrothermal approach to enhance the photocatalytic performance under the visible light irradiation. The proposed ZnWO4/g-C3N4 nanocomposite photocatalyst shows excellent photodegradation towards organic dyes, such as methylene blue (MB) and rhodamine B (RhB). The optimal loading of ZnWO4 and g-C3N4 leads to the synergistic effect which plays a predominant role in inhibiting the fast electron-hole pairs recombination rate at the interface of ZnWO4/g-C3N4 photocatalyst. The degradation rates of MB and RhB is achieved around 92.9 % and 88.8 % under the visible light irradiation for 120 min. According to our findings, the radical quenching experiments suggested that the ●OH radicals played a positive impact in the photodegradation process. Since, our proposed photocatalyst exhibit superior photocatalytic activity towards the individual MB and RhB degradation. The ZnWO4/g-C3N4 photocatalyst were further applied to demonstrate the degradation of mixed dyes (MB and RhB) at an irradiation time of 180 min. In the mixed dye solution, the ZnWO4/g-C3N4 photocatalyst achieved a highest reaction rate of 0.010 min−1 for MB and 0.012 min−1 for RhB with the degradation rate of 87.8 % and 83.3 % for RhB and MB, respectively. For the mixed dyes, the radical quenching experiments confirmed that the ●OH radicals are responsible for the fast photodegradation. Additionally, the practicality of the proposed ZnWO4/g-C3N4 photocatalyst towards the degradation of MB, RhB and the mixed dyes were examined in the tap water samples. Furthermore, the plausible photodegradation mechanism of ZnWO4/g-C3N4 photocatalyst was proposed in detail. This study provides a new insight for the simultaneous degradation of mixed chemical pollutants using our proposed ZnWO4/g-C3N4 photocatalyst.