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1.
Molecules ; 27(22)2022 Nov 16.
Artigo em Inglês | MEDLINE | ID: mdl-36432027

RESUMO

Perovskite solar cells (PSCs) offer advantages over widely deployed silicon solar cells in terms of ease of fabrication; however, the device is still under rigorous materials optimization for cell performance, stability, and cost. In this work, we explore a version of a PSC by replacing the polymeric hole transport layer (HTL) such as Spiro-OMeTAD, P3HT, and PEDOT: PSS with a more air-stable metal oxide, viz., nitrogen-doped titanium dioxide (TiO2:N). Numerical simulations on formamidinium (FA)-based PSCs in the FTO/TiO2/FAPbI3/Ag configuration have been carried out to depict the behaviour of the HTL as well as the effect of absorber layer thickness (∆t) on photovoltaic parameters. The results show that the cell output increases when the HTL bandgap increases from 2.5 to 3.0 eV. By optimizing the absorber layer thickness and the gradient in defect density (Nt), the device structure considered here can deliver a maximum power conversion efficiency of ~21.38% for a lower HTL bandgap (~2.5 eV) and ~26.99% for a higher HTL bandgap of ~3.0 eV. The results are validated by reproducing the performance of PSCs employing commonly used polymeric HTLs, viz. Spiro-OMeTAD, P3HT, and PEDOT: PSS as well as high power conversion efficiency in the highly crystalline perovskite layer. Therefore, the present study provides high-performing, cost-effective PSCs using TiO2:N.

2.
J Nanosci Nanotechnol ; 19(4): 2027-2033, 2019 04 01.
Artigo em Inglês | MEDLINE | ID: mdl-30486943

RESUMO

A multiporous nanofiber (MPNFs) of SnO2 and chitosan has been used for the immobilization of a redox protein, hemoglobin (Hb), onto the surface of glassy carbon electrode (GCE). The multiporous nanofiber of SnO2 that has very high surface area is synthesized by using electrospinning technique through controlling the tin precursor concentration. Since the constructed MPNFs of SnO2 exposes very high surface area, it increases the efficiency for biomolecule-loading. The morphology of fabricated electrodes is examined by SEM observation and the absorbance spectra of Hb/(MPNFs) of SnO2 are studied by UV-Vis analysis. Cyclic Voltammetry and amperometry are employed to study and optimize the performance of the resulting fabricated electrode. After fabrication of the electrode with the Hb and MPNFs of SnO2, a direct electron transfer between the protein's redox centre and the glassy carbon electrode was established. The modified electrode has showed a couple of redox peak located at -0.29 V and -0.18 V and found to be sensitive to H2O2. The fabricated electrode also exhibited an excellent electrocatalytic activity towards the reduction of H2O2. The catalysis currents increased linearly to the H2O2 concentration in a wide range of 5.0×10-6-1.5×10-4 M. Overall experimental results show that MPNFs of SnO2 has a role towards the enhancement of the electroactivity of Hb at the electrode surface. Thus the MPNFs of SnO2 is a very promising candidate for future biosensor applications.


Assuntos
Técnicas Biossensoriais , Quitosana , Hemoglobinas , Peróxido de Hidrogênio/análise , Proteínas Imobilizadas , Nanofibras , Catálise , Eletrodos , Compostos de Estanho
3.
Langmuir ; 34(5): 1873-1882, 2018 02 06.
Artigo em Inglês | MEDLINE | ID: mdl-29345940

RESUMO

This article reports the synthesis of cuprous oxide (Cu2O) and cupric oxide (CuO) nanowires by controlling the calcination environment of electrospun polymeric nanowires and their charge storage properties. The Cu2O nanowires showed higher surface area (86 m2 g-1) and pore size than the CuO nanowires (36 m2 g-1). Electrochemical analysis was carried out in 6 M KOH, and both the electrodes showed battery-type charge storage mechanism. The electrospun Cu2O electrodes delivered high discharge capacity (126 mA h g-1) than CuO (72 mA h g-1) at a current density of 2.4 mA cm-2. Electrochemical impedance spectroscopy measurements show almost similar charge-transfer resistance in Cu2O (1.2 Ω) and CuO (1.6 Ω); however, Cu2O showed an order of magnitude higher ion diffusion. The difference in charge storage between these electrodes is attributed to the difference in surface properties and charge kinetics at the electrode. The electrode also shows superior cyclic stability (98%) and Coulombic efficiency (98%) after 5000 cycles. Therefore, these materials could be acceptable choices as a battery-type or pseudocapacitive electrode in asymmetric supercapacitors.

4.
Phys Chem Chem Phys ; 19(1): 408-418, 2016 Dec 21.
Artigo em Inglês | MEDLINE | ID: mdl-27905607

RESUMO

This article addresses the heat capacity of quantum dots (QDs) using density functional theory (DFT). By analyzing the evolution of phonon density of states and heat capacity as CdSe clusters grow from a molecular cluster into larger quantum confined solids, we have shown that their heat capacity does not fit very well with the Debye T3 model. We observed that the number of phonon modes, which is discrete, increases as the particles grow, and the dispersion relation shows a quadratic behavior in contrast to the bulk solids whose dispersion relation is linear and equal to the sound velocity. The phonon density of states showed a square root variation with respect to frequency whereas that of the bulk is a quadratic variation of frequency. From the observed variation in the phonon density of states and holding the fact that the atomic vibrations in solids are elastically coupled, we have re-derived the expression for total energy of the QDs and arrive at a T3/2 model of heat capacity, which fits very well to the observed heat capacity data. These results give promising directions in the understanding of the evolution of the thermophysical properties of solids.

5.
Phys Chem Chem Phys ; 18(31): 21629-39, 2016 Aug 21.
Artigo em Inglês | MEDLINE | ID: mdl-27432518

RESUMO

Despite the high efficiency of over 21% reported for emerging thin film perovskite solar cells, one of the key issues prior to their commercial deployment is to attain their long term stability under ambient and outdoor conditions. The instability in perovskite is widely conceived to be humidity induced due to the water solubility of its initial precursors, which leads to decomposition of the perovskite crystal structure; however, we note that humidity alone is not the major degradation factor and it is rather the photon dose in combination with humidity exposure that triggers the instability. In our experiment, which is designed to decouple the effect of humidity and light on perovskite degradation, we investigate the shelf-lifetime of CH3NH3PbI3 films in the dark and under illumination under high humidity conditions (Rel. H. > 70%). We note minor degradation in perovskite films stored in a humid dark environment whereas upon exposure to light, the films undergo drastic degradation, primarily owing to the reactive TiO2/perovskite interface and also the surface defects of TiO2. To enhance its air-stability, we incorporate CH3NH3PbI3 perovskite in a polymer (poly-vinylpyrrolidone, PVP) matrix which retained its optical and structural characteristics in the dark for ∼2000 h and ∼800 h in room light soaking, significantly higher than a pristine perovskite film, which degraded completely in 600 h in the dark and in less than 100 h when exposed to light. We attribute the superior stability of PVP incorporated perovskite films to the improved structural stability of CH3NH3PbI3 and also to the improved TiO2/perovskite interface upon incorporating a polymer matrix. Charge injection from the polymer embedded perovskite films has also been confirmed by fabricating solar cells using them, thereby providing a promising future research pathway for stable and efficient perovskite solar cells.

6.
Nanotechnology ; 26(10): 105401, 2015 Mar 13.
Artigo em Inglês | MEDLINE | ID: mdl-25687409

RESUMO

Working electrode (WE) fabrication offers significant challenges in terms of achieving high-efficiency dye-sensitized solar cells (DSCs). We have combined the beneficial effects of vertical nanorods grown on conducting glass substrate for charge transport and mesoporous particles for dye loading and have achieved a high photoconversion efficiency of (η) > 11% with an internal quantum efficiency of ∼93% in electrode films of thickness ∼7 ± 0.5 µm. Controlling the interface between the vertical nanorods and the mesoporous film is a crucial step in attaining high η. We identify three parameters, viz., large surface area of nanoparticles, increased light scattering of the nanorod-nanoparticle layer, and superior charge transport of nanorods, that simultaneously contribute to the improved photovoltaic performance of the WE developed.

7.
Nanotechnology ; 26(49): 494002, 2015 Dec 11.
Artigo em Inglês | MEDLINE | ID: mdl-26574237

RESUMO

The past few years have witnessed remarkable progress in solution-processed methylammonium lead halide (CH3NH3PbX3, X = halide) perovskite solar cells (PSCs) with reported photoconversion efficiency (η) exceeding 20% in laboratory-scale devices and reaching up to 13% in their large area perovskite solar modules (PSMs). These devices mostly employ mesoporous TiO2 nanoparticles (NPs) as an electron transport layer (ETL) which provides a scaffold on which the perovskite semiconductor can grow. However, limitations exist which are due to trap-limited electron transport and non-complete pore filling. Herein, we have employed TiO2 nanorods (NRs), a material offering a two-fold higher electronic mobility and higher pore-filing compared to their particle analogues, as an ETL. A crucial issue in NRs' patterning over substrates is resolved by using precise Nd:YVO4 laser ablation, and a champion device with η ∼ 8.1% is reported via a simple and low cost vacuum-vapor assisted sequential processing (V-VASP) of a CH3NH3PbI3 film. Our experiments showed a successful demonstration of NRs-based PSMs via the V-VASP technique which can be applied to fabricate large area modules with a pin-hole free, smooth and dense perovskite layer which is required to build high efficiency devices.

8.
Bioprocess Biosyst Eng ; 38(1): 15-24, 2015 Jan.
Artigo em Inglês | MEDLINE | ID: mdl-24981021

RESUMO

Anode biofilm is a crucial component in microbial fuel cells (MFCs) for electrogenesis. Better knowledge about the biofilm development process on electrode surface is believed to improve MFC performance. In this study, double-chamber microbial fuel cell was operated with diluted POME (initial COD = 1,000 mg L(-1)) and polyacrylonitrile carbon felt was used as electrode. The maximum power density, COD removal efficiency and Coulombic efficiency were found as 22 mW m(-2), 70 and 24 %, respectively. FTIR and TGA analysis confirmed the formation of biofilm on the electrode surface during MFC operation. The impact of anode biofilm on anodic polarization resistance was investigated using electrochemical impedance spectroscopy (EIS) and microbial community changes during MFC operation using denaturing gradient gel electrophoresis (DGGE). The EIS-simulated results showed the reduction of charge transfer resistance (R ct) by 16.9 % after 14 days of operation of the cell, which confirms that the development of the microbial biofilm on the anode decreases the R ct and therefore improves power generation. DGGE analysis showed the variation in the biofilm composition during the biofilm growth until it forms an initial stable microbial community, thereafter the change in the diversity would be less. The power density showed was directly dependent on the biofilm development and increased significantly during the initial biofilm development period. Furthermore, DGGE patterns obtained from 7th and 14th day suggest the presence of less diversity and probable functional redundancy within the anodic communities possibly responsible for the stable MFC performance in changing environmental conditions.


Assuntos
Fontes de Energia Bioelétrica , Biofilmes , Óleos de Plantas/química , Eletroforese em Gel de Gradiente Desnaturante , Espectroscopia Dielétrica , Microscopia Eletrônica de Varredura , Óleo de Palmeira , Espectroscopia de Infravermelho com Transformada de Fourier
9.
Phys Chem Chem Phys ; 16(16): 7448-54, 2014 Apr 28.
Artigo em Inglês | MEDLINE | ID: mdl-24626637

RESUMO

Metal oxide semiconductors offering simultaneously high specific surface area and high electron mobility are actively sought for fabricating high performance nanoelectronic devices. The present study deals with synthesis of tungsten doped TiO2 (W:TiO2) nanowires (diameter ∼50 nm) by electrospinning and evaluation of their performance in dye-sensitized solar cells (DSCs). Similarity in the ionic radii between W(6+) and Ti(4+) and availability of two free electrons per dopant are the rationale for the present study. Materials were characterized by X-ray diffraction, scanning and transmission electron microscopy, X-ray fluorescence measurements, and absorption spectroscopy. Nanowires containing 2 at% W:TiO2 gave 90% higher short circuit current density (JSC) (∼15.39 mA cm(-2)) in DSCs with a nominal increase in the open circuit voltage compared with that of the undoped analogue (JSC ∼8.1 mA cm(-2)). The results are validated by multiple techniques employing absorption spectroscopy, electrochemical impedance spectroscopy and open circuit voltage decay. The above studies show that the observed increments resulted from increased dye-loading, electron density, and electron lifetime in tungsten doped samples.

10.
J Colloid Interface Sci ; 661: 1070-1081, 2024 May.
Artigo em Inglês | MEDLINE | ID: mdl-38368230

RESUMO

The growing use of EVs and society's energy needs require safe, affordable, durable, and eco-friendly high-energy lithium-ion batteries (LIBs). To this end, we synthesized and investigated the removal of Co from Al-doped Ni-rich cathode materials, specifically LiNi0.9Co0.1Al0.0O2 (NCA-0), LiNi0.9Mn0.1Al0.0O2 (NMA-0), LiNi0.9Mn0.07Al0.03O2 (NMA-3), intending to enhance LIB performance and reduce the reliance on cobalt, a costly and scarce resource. Our study primarily focuses on how the removal of Co affects the material characteristics of Ni-rich cathode material and further introduces aluminum into the cathode composition to study its impacts on electrochemical properties and overall performance. Among the synthesized samples, we discovered that the NMA-3 sample, modified with 3 mol% of Al, exhibited superior battery performance, demonstrating the effectiveness of aluminum in promoting cathode stability. Furthermore, the Al-modified cathode showed promising cycle life under normal and high-temperature conditions. Our NMA-3 demonstrated remarkable capacity retention of âˆ¼ 88 % at 25 °C and âˆ¼ 81 % at 45 °C after 200 cycles at 1C, within a voltage range of 2.8-4.3 V, closely matching the performances of conventional NCM and NCA cathodes. Without cobalt, the cathodes exhibited increased cation disorder leading to inferior rate capabilities at high C-rates. In-situ transmission XRD analysis revealed that the introduction of Al has reduced the phase change and provided much-needed stability to the overall structure of the Co-free NMA-3. Altogether, the findings suggest that our aluminum-modified NMA-3 sample offers a promising approach to developing Co-free, Ni-rich cathodes, effectively paving the way toward sustainable, high-energy-density LIBs.

11.
J Colloid Interface Sci ; 658: 699-713, 2024 Mar 15.
Artigo em Inglês | MEDLINE | ID: mdl-38141392

RESUMO

Due to the poor thermal stability of conventional separators, lithium-ion batteries require a suitable separator to maintain system safety for long-term cycling performance. It must have high porosity, superior electrolyte uptake ability, and good ion-conducting properties even at high temperatures. In this work, we demonstrate a novel composite membrane based on sandwiching of zeolitic imidazole frameworks-67 decorated cellulose acetate nanofibers (ZIF-67@CA) with electrospun poly(vinyl alcohol)/melamine (denoted as PVAM) nonwoven membranes. The as-prepared sandwich-type membranes are called PVAM/x%ZIF-67@CA/PVAM. The middle layer of composite membranes is primarily filled with different weight percentages of ZIF-67 nanoparticles (x = 5, 15, and 25 wt%), which both reduces the non-uniform porous structure of CA and increases its thermal stability. Therefore, our sandwich-type PVAM/x%ZIF-67@CA/PVAM membrane exhibits a higher thermal shrinkage effect at 200 °C than the commercial polyethylene (PE) separator. Due to its high electrolyte uptake (646.8%) and porosity (85.2%), PVAM/15%ZIF-67@CA/PVAM membrane achieved high ionic conductivity of 1.46 × 10-3 S cm-1 at 70 °C, as compared to the commercial PE separator (ca. 6.01 × 10-4 S cm-1 at 70 °C). Besides, the cell with PVAM/15%ZIF-67@CA/PVAM membrane shows an excellent discharge capacity of about 167.5 mAh g-1after 100 cycles at a 1C rate with a capacity retention of 90.3%. The ZIF-67 fillers in our sandwich-type composite membrane strongly attract anions (PF6-) through Lewis' acid-base interaction, allowing uniform Li+ ion transport and suppressing Li dendrites. As a result, we found that the PVAM/15%ZIF-67@CA/PVAM composite nonwoven membrane is applicable to high-power, high-safety lithium-ion battery systems that can be used in electric vehicles (EVs).

12.
J Colloid Interface Sci ; 661: 289-306, 2024 May.
Artigo em Inglês | MEDLINE | ID: mdl-38301467

RESUMO

A novel scalable Taylor-Couette reactor (TCR) synthesis method was employed to prepare Ta-modified LiNi0.92Co0.04Mn0.04O2 (T-NCM92) with different Ta contents. Through experiments and density functional theory (DFT) calculations, the phase and microstructure of Ta-modified NCM92 were analyzed, showing that Ta provides a bifunctional (doping and coating at one time) effect on LiNi0.92Co0.04Mn0.04O2 cathode material through a one-step synthesis process via a controlling suitable amount of Ta and Li-salt. Ta doping allows the tailoring of the microstructure, orientation, and morphology of the primary NCM92 particles, resulting in a needle-like shape with fine structures that considerably enhance Li+ ion diffusion and electrochemical charge/discharge stability. The Ta-based surface-coating layer effectively prevented microcrack formation and inhibited electrolyte decomposition and surface-side reactions during cycling, thereby significantly improving the electrochemical performance and long-term cycling stability of NCM92 cathodes. Our as-prepared NCM92 modified with 0.2 mol% Ta (i.e., T2-NCM92) exhibits outstanding cyclability, retaining 84.5 % capacity at 4.3 V, 78.3 % at 4.5 V, and 67.6 % at 45 â„ƒ after 200 cycles at 1C. Even under high-rate conditions (10C), T2-NCM92 demonstrated a remarkable capacity retention of 66.9 % after 100 cycles, with an initial discharge capacity of 157.6 mAh g-1. Thus, the Ta modification of Ni-rich NCM92 materials is a promising option for optimizing NCM cathode materials and enabling their use in real-world electric vehicle (EV) applications.

13.
Heliyon ; 10(14): e34436, 2024 Jul 30.
Artigo em Inglês | MEDLINE | ID: mdl-39082013

RESUMO

Current commercial separators used in lithium-ion batteries have inherent flaws, especially poor thermal stability, which pose substantial safety risks. This study introduces a high-safety composite membrane made from electrospun poly(vinyl alcohol)-melamine (PVAM) and polyvinylidene fluoride (PVDF) polymer solutions via a dip coating method, designed for high-voltage battery systems. The poly(vinyl alcohol) and melamine components enhance battery safety, while the PVDF coating improves lithium-ion conductivity. The dip-coated PVDF/Esp-PVAM composite separators were evaluated for electrolyte uptake, contact angle, thermal stability, porosity, electrochemical stability and ionic conductivity. Notably, our Dip 1 % PVDF@Esp-PVAM composite separator exhibited excellent wettability and a lithium-ion conductivity of approximately 7.75 × 10⁻4 S cm⁻1 at room temperature. These separators outperformed conventional PE separators in half-cells with Ni-rich NCM811 cathodes, showing exceptional cycling stability with 93.4 % capacity retention after 100 cycles at 1C/1C, as compared to 84.8 % for PE separators. Our Dip 1 % PVDF@Esp-PVAM composite separator demonstrates significant potential for enhancing the long-term durability and high-rate performance of lithium-ion batteries, making it a promising option for long-term energy storage applications.

14.
Phys Chem Chem Phys ; 15(38): 16275-85, 2013 Oct 14.
Artigo em Inglês | MEDLINE | ID: mdl-24000052

RESUMO

The possibility of achieving many electrons per absorbed photon of sufficient energy by quantum dots (QDs) drives the motivation to build high performance quantum dot solar cells (QDSCs). Although performance of dye-sensitized solar cells (DSCs), with similar device configuration as that of QDSCs, has significantly improved in the last two decades QDSCs are yet to demonstrate impressive device performances despite the remarkable features of QDs as light harvesters. We investigated the fundamental differences in the optical properties of QDs and dyes using DFT calculations to get insights on the inferior performance of QDSCs. The CdSe QDs and the ruthenium bipyridyl dicarboxylic acid dye (N3) were used as typical examples in this study. Based on a generalized equation of state correlating material properties and photoconversion efficiency, we calculated ground and excited state properties of these absorbers at the B3LYP/lanl2dz level of DFT and analyzed them on the basis of the device performance. Five missing links have been identified in the study which provides numerous insights into building high efficiency QDSCs. They are (i) fundamental differences in the emitting states of the QDs in the strong and weak confinement regimes were observed, which explained successfully the performance differences; (ii) the crucial role of bifunctional ligands that bind the QDs and the photo-electrode was identified; in most cases use of bifunctional ligands does not lead to a QD enabled widening of the absorption of the photo-electrode; (iii) wide QDs size distribution further hinders efficient electron injections; (iv) wide absorption cross-section of QDs favours photon harvesting; and (v) the role of redox potential of the electrolyte in the QD reduction process.

15.
Phys Chem Chem Phys ; 15(18): 6831-41, 2013 May 14.
Artigo em Inglês | MEDLINE | ID: mdl-23545599

RESUMO

This article demonstrates improvements in the operational stability of organic solar cells (OSCs) by taking advantage of the relationship between oxygen stoichiometry and conductivity in nanostructured metal oxide semiconductors (n-MOS). OSCs in the inverted device configuration of ITO/Ca/P3HT:PCBM/MoO3/Ag were employed in the present study. A high degree of oxygen defects were introduced in the hole-conducting MoO3 layer by annealing the devices under vacuum (≥10(-5) mbar) for nominal temperature (120 °C) and time (10 min). The above devices had much higher operational stability, when tested following the ISOS-D-1 (shelf) protocol, than control devices annealed conventionally, i.e., in nitrogen atmosphere. Employing current-voltage measurement as functions of temperature and photon flux, we show that the devices annealed under vacuum have a lesser density of traps than those annealed in nitrogen. The lesser trap density is shown to be beneficial in reducing the rate of electron recombination thereby increasing the operational stability of the corresponding device. A number of experiments were undertaken to show that the difference in the operation stability of the device results from the difference in conductivity of the nanostructured MoO3 hole transporting layer. The charge extraction by linear increasing voltage spectroscopy shows that charges are relaxed at the trap states in the device annealed in nitrogen whereas they are efficiently transported in the other device. We identify that building up of an interfacial potential barrier as a result of the charge relaxation at the trap states and the corresponding chemical changes in the devices annealed conventionally is the source of degradation of the device performance over time. To our knowledge, this is the first report that successfully overcomes hole-conductivity induced degradation in organic solar cells.

16.
Phys Chem Chem Phys ; 15(43): 19057-64, 2013 Nov 21.
Artigo em Inglês | MEDLINE | ID: mdl-24100603

RESUMO

This article addresses simultaneous improvements in the photovoltaic performance and operational stability of organic photovoltaic devices (OPVs) in the inverted configuration when nanostructured ZnO characterized by a lower density of localized surface atomic energy states is employed as an electron transport layer. Two sets of devices with the configuration ITO/ZnO/P3HT:PCBM/MoO3/Ag are employed in the present study. A difference in the density of localized energy states in the band gap of ZnO was produced by altering the crystallinity by annealing the ZnO at two temperatures, viz. 160 and 240 °C. The devices are characterized by scanning electron microscopy, X-ray diffractometry, current-voltage (I-V) measurements as functions of temperature and illumination intensity, incident photon to current conversion efficiency (IPCE) spectroscopy, and charge extraction by linearly increasing photovoltage (CELIV) spectroscopy. The devices fabricated using the ZnO nanostructures annealed at 240 °C have shown remarkably higher power conversion efficiency (PCE) and IPCE values than the other device. From I-V measured as a function of photon flux and temperature we show that the device with higher PCE is characterized by a lower depth of localized energy states by a factor of two than the other device. The implications of the lower trap depth was also evaluated using CELIV and the corresponding charge mobility obtained differed by a factor of three between the two sets of devices. The device with lower equilibrium concentration at the interface has three fold higher charge mobility and 40% enhanced photoconversion efficiency. The stability of the devices was evaluated with and without encapsulation under simulated sunlight (AM 1.5) following the ISOS-D-1 (shelf) and the ISOS-L-1 protocols; the device with higher PCE also showed higher operational stability. The findings in this study are expected to provide new directions in fabricating organic-inorganic heterojunction devices with high performance and stability.

17.
ACS Omega ; 8(2): 2629-2638, 2023 Jan 17.
Artigo em Inglês | MEDLINE | ID: mdl-36687114

RESUMO

Charge storage in electrochemical double-layer capacitors (EDLCs) is via the adsorption of electrolyte counterions in their positive and negative electrodes under an applied potential. This study investigates the EDLC-type charge storage in carbon nanotubes (CNT) electrodes in aqueous acidic (NaHSO4), basic (NaOH), and neutral (Na2SO4) electrolytes of similar cations but different anions as well as similar anions but different cations (Na2SO4 and Li2SO4) in a two-electrode Swagelok-type cell configuration. The physicochemical properties of ions, such as mobility/diffusion and solvation, are correlated with the charge storage parameters. The neutral electrolytes offer superior charge storage over the acidic and basic counterparts. Among the studied ions, SO4 2- and Li+ showed the most significant capacitance owing to their larger solvated ion size. The charge stored by the anions and cations follows the order SO4 2- > HSO4 - > OH- and Li+ > Na+, respectively. Consequently, the CNT//Li2SO4//CNT cell displayed outstanding charge storage indicators (operating voltage ∼0-2 V, specific capacitance ∼122 F·g-1, specific energy ∼67 W h·kg-1, and specific power ∼541 W·kg-1 at 0.5 A·g-1) than the other cells, which could light a red light-emitting diode (2.1 V) for several minutes. Besides, the CNT//Li2SO4//CNT device showed exceptional rate performance with a capacitance retention of ∼95% at various current densities (0.5-2.5 A·g-1) after 6500 cycles. The insights from this work could be used to design safer electrochemical capacitors of high energy density and power density.

18.
Heliyon ; 9(9): e20003, 2023 Sep.
Artigo em Inglês | MEDLINE | ID: mdl-37809409

RESUMO

This article reports a tool that enables Materials Informatics, termed as MatRec, via a deep learning approach. The tool captures data, makes appropriate domain suggestions, extracts various entities such as materials and processes, and helps to establish entity-value relationships. This tool uses keyword extraction, a document similarity index to suggest relevant documents, and a deep learning approach employing Bi-LSTM for entity extraction. For example, materials and processes for electrical charge storage under an electric double layer capacitor (EDLC) mechanism are demonstrated herewith. A knowledge graph approach finds and visualizes different latent knowledge sets from the processed information. The MatRec received an F1 score of 9̃6% for entity extraction, 8̃3% for material-value relationship extraction, and 8̃7% for process-value relationship extraction, respectively. The proposed MatRec could be extended to solve material selection issues for various applications and could be an excellent tool for academia and industry.

19.
Chemosphere ; 317: 137848, 2023 Mar.
Artigo em Inglês | MEDLINE | ID: mdl-36642147

RESUMO

Synthetic plastics, which are lightweight, durable, elastic, mouldable, cheap, and hydrophobic, were originally invented for human convenience. However, their non-biodegradability and continuous accumulation at an alarming rate as well as subsequent conversion into micro/nano plastic scale structures via mechanical and physio-chemical degradation pose significant threats to living beings, organisms, and the environment. Various minuscule forms of plastics detected in water, soil, and air are making their passage into living cells. High temperature and ambient humidity increase the degradation potential of plastic polymers photo-catalytically under sunlight or UV-B radiations. Microplastics (MPs) of polyethylene terephthalate, polyethylene, polystyrene, polypropylene, and polyvinyl chloride have been detected in bottled water. These microplastics are entering into the food chain cycle, causing serious harm to all living organisms. MPs entering into the food chain are usually inert in nature, possessing different sizes and shapes. Once they enter a cell or tissue, it causes mechanical damage, induces inflammation, disturbs metabolism, and even lead to necrosis. Various generation routes, types, impacts, identification, and treatment of microplastics entering the water bodies and getting associated with various pollutants are discussed in this review. It emphasizes potential detection techniques like pyrolysis, gas chromatography-mass spectrometry (GC-MS), micro-Raman spectroscopy, and fourier transform infrared spectroscopy (FT IR) spectroscopy for microplastics from water samples.


Assuntos
Água Potável , Poluentes Químicos da Água , Humanos , Água Potável/análise , Microplásticos , Prevalência , Plásticos , Monitoramento Ambiental/métodos , Poluentes Químicos da Água/análise
20.
J Colloid Interface Sci ; 639: 145-159, 2023 Jun.
Artigo em Inglês | MEDLINE | ID: mdl-36804788

RESUMO

Nickel-rich (Ni > 90 %) cathodes are regarded as one of the most attractive because of their high energy density, despite their poor stability and cycle life. To improve their performance, in this study we synthesized a double concentration-gradient layered Li[Ni0.90Co0.04Mn0.03Al0.03]O2 oxide (CG-NCMA) using a continuous co-precipitation Taylor-Couette cylindrical reactor (TCCR) with a Ni-rich-core, an Mn-rich surface, and Al on top. The concentration-gradient morphology was confirmed through cross-sectional EDX line scanning. The as-synthesized sample exhibited excellent electrochemical performance at high rates (5C/10C), as well as cyclability (91.5 % after 100 cycles and 70.3 % after 500 cycles at 1C), superior to that (83.4 % and 47.6 %) of its non-concentration-gradient counterpart (UC-NCMA). The Mn-rich surface and presence of Al helped the material stay structurally robust, even after 500 cycles, while also suppressing side reactions between the electrode and electrolyte, resulting in better overall electrochemical performance. These enhancements in performance were studied using TEM, SEM, in-situ-XRD, XPS, CV, EIS and post-mortem analyses. This synthetic method enables the highly scalable production of CG-NCMA samples with two concentration-gradient structures for practical applications in Li-ion batteries.

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