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1.
Dalton Trans ; 53(24): 10318-10327, 2024 Jun 17.
Artigo em Inglês | MEDLINE | ID: mdl-38832990

RESUMO

A two-step simple and efficient ion-exchange chemical strategy is proposed to obtain nanostructured Bi2S3 electrodes of different surface morphologies from the Bi2O3. In the first step, nanoplates of the Bi2O3 are obtained on nickel-foam using successive ionic layer adsorption and reaction method at room-temperature (25 °C). In the second phase, as-obtained nanoplates of the Bi2O3 are transferred to the Bi2S3 using four autoclaves containing different sulfur precursor solutions at 120 °C for 8 h for phase change, structural conversion and surface morphological modification (i.e., walnuts, network-type, nanowires, and nanoflowers). Due to higher surface area and conductivity, lower charge transfer resistance, and reduced band gap caused by ionic and phase conversion, the Bi2S3 surpasses the Bi2O3 in hydrogen evolution reaction (HER) and oxygen evolution reaction (OER) activities. The overpotential of 112-370 mV for the Bi2S3 network is much lower than that of the nanoplates of the Bi2O3 (275-543 mV), and walnuts (134-464 mV), nanowires (125-500 mV), and nanoflowers (194-520 mV) of the Bi2S3. The Bi2S3 network-type Bi2S3 electrode shows considerable chemical stability through cycling measurement, suggesting the importance of the present study in obtaining metal sulfides from metal oxide with better water splitting activities.

2.
Sci Rep ; 14(1): 5064, 2024 Mar 01.
Artigo em Inglês | MEDLINE | ID: mdl-38424129

RESUMO

Understanding the metal-semiconductor heterostructure interface is crucial for the development of spintronic devices. One of the prospective candidates and extensively studied semiconductors is molybdenum disulfide (MoS 2 ). Herein, utilizing Kerr microscopy, we investigated the impact of thick MoS 2 on the magnetic properties of the 10 nm Co layer. A comparative study on Co / MoS 2 and Co/Si shows that coercivity increased by 77% and the Kerr signal decreased by 26% compared to Co grown on Si substrate. In addition, the Co domain structure significantly changed when grown on MoS 2 . The plausible reason for the observed magnetic behavior can be that the Co interacts differently at the interface of MoS 2 as compared to Si. Therefore, our studies investigate the interfacial effect on the magnetic properties of Co grown on thick MoS 2 layer. Furthermore, our results will help in developing next-generation spintronic devices.

3.
Chemosphere ; 350: 141080, 2024 Feb.
Artigo em Inglês | MEDLINE | ID: mdl-38163467

RESUMO

The chemical conversion of plastic waste into metal-organic framework (MOF) materials has emerged as a significant research field in addressing issues associated to the environment and the economy. The significant advantages of MOFs as electrode material for energy/supercapacitors arises from their extensive surface area and notable porosity. The present study involved the synthesis of Zirconium-Metal Organic Frameworks (Zr-MOF) by the solvothermal method, utilizing plastic waste in the form of Polyethylene terephthalate (PET) bottles. The morphological and structural characteristics of the Zr-MOF were inspected through several analytical techniques, including scanning electron microscopy, transmission electron microscopy, X-ray diffraction, and Fourier-transform infrared spectroscopy analysis. The as prepared Zr-MOF demonstrated very high specific surface area of 927.567 m2 g-1 with mesoporous nature of the materials estimate by BJH method. The electrochemical characteristics of the Zr-MOF in 3-electrode system exhibited a notable specific capacitance of 822 F g-1 when subjected to a low scan rate of 2 mV S-1, while the specific capacitance estimated through galvanostatic charge-discharge exhibited an enhanced value of 890 F g-1 at a current density of 0.5 A g-1. Additionally, the working electrode composed of Zr-MOF demonstrated noteworthy capacitance retention of 92% after 5000 charge discharge cycles. This research presents novel opportunities for the utilization of waste PET bottles in fabrication of highly functional Zr-MOF, aiming to advance the development of next-generation supercapacitors and environmental remediation.


Assuntos
Recuperação e Remediação Ambiental , Estruturas Metalorgânicas , Polietilenotereftalatos , Capacitância Elétrica , Eletrodos
4.
Chemosphere ; 351: 141244, 2024 Mar.
Artigo em Inglês | MEDLINE | ID: mdl-38242515

RESUMO

Amines, which are classified as volatile organic compounds (VOCs), serve a variety of purposes in the fields of environmental monitoring, food safety, and healthcare diagnosis. The present technique for detecting amine levels involves sophisticated setups and bulky equipment. Here. In this study, a chemoresistive gas sensor is developed that is cost-effective and easy to operate at room temperature (RT). The sensor is designed specifically for the detection of Ammonia, dimethylamine (DMA), trimethylamine (TMA), and total volatile basic nitrogen (TVB-N). Using biphenyl-reduced graphene oxide (B-rGO) composite gas sensors effectively addresses the issues of low sensitivity-selectivity and long-term instability commonly observed in conventional amine sensors. B-rGO sensor produced sensitivity of ∼3500 and selectivity above 30 for TVB-N sensing. The sensor is stable for temperature fluctuations below 50 °C and shows stable sensing response for period of over 3 months. A Chemoresistive B-rGO sensor was developed using an ultrasonic spray deposition system with optimized flow rate of 50 mL/h. Rapid evaporation of solvent using hot plate has resulted in unique morphology for B-rGO film sensors. The highest sensitivity, ∼836, is obtained for 100 ppm of ammonia with ammonia > DMA > TMA as a sensitivity order. B-rGO showed almost seven times higher amine sensitivity than rGO which highlights the importance of biphenyl in the B-rGO composite. Sensor calibration curve has been presented in the study to understand change in the sensitivity of sensor with increasing analyte gas concentration. The calibration curve has an average R-squared value of 0.98.


Assuntos
Aminas , Amônia , Compostos de Bifenilo , Dimetilaminas , Grafite , Metilaminas , Temperatura , Nitrogênio
5.
Micromachines (Basel) ; 14(12)2023 Dec 17.
Artigo em Inglês | MEDLINE | ID: mdl-38138420

RESUMO

One of the primary objectives of scientific research is to create state-of-the-art multiferroic (MF) materials that exhibit interconnected properties, such as piezoelectricity, magnetoelectricity, and magnetostriction, and remain functional under normal ambient temperature conditions. In this study, we employed first-principles calculations to investigate how changing pnictogen elements affect the structural, electronic, magnetic, and optical characteristics of QFeO3 (Q = Bi, P, SB). Electronic band structures reveal that BiFeO3 is a semiconductor compound; however, PFeO3 and SbFeO3 are metallic. The studied compounds are promising for spintronics, as they exhibit excellent magnetic properties. The calculated magnetic moments decreased as we replaced Bi with SB and P in BiFeO3. A red shift in the values of ε2(ω) was evident from the presented spectra as we substituted Bi with Sb and P in BiFeO3. QFeO3 (Q = Bi, P, SB) showed the maximum absorption of incident photons in the visible region. The results obtained from calculating the optical parameters suggest that these materials have a strong potential to be used in photovoltaic applications.

6.
Dalton Trans ; 52(33): 11481-11488, 2023 Aug 22.
Artigo em Inglês | MEDLINE | ID: mdl-37534542

RESUMO

The successful deployment of sodium-ion batteries (SIBs) requires high-performance sustainable and cost-effective anode materials having a high current density. In this regard, sodium disulphide (NiS2) has been prepared as a composite with activated carbon (C) using a facile hydrothermal synthesis route in the past. The X-ray diffraction pattern of the as-prepared NiS2/C composite material shows well-defined diffraction peaks of NiS2. Most carbonaceous materials are amorphous, and the Brunauer-Emmett-Teller (BET) study shows that the surface area is close to 148 m2 g-1. At a current density of 50 mA g-1, the NiS2/C composite exhibits a high capacity of 480 mA h g-1 during the initial cycle, which subsequently decreases to 333 mA h g-1 after the completion of the 100th cycle. The NiS2/C composite electrode provides an exceptional rate capability by delivering a capacity of 270 mA h g-1 at a high current density of 2000 mA g-1, suggesting the suitability of the NiS2/C composite for SIBs. Ex situ X-ray absorption near edge structure (XANES) and extended X-ray absorption fine structure (EXAFS) analyses at the Ni K-edge have been used to examine the type of chemical bonding present in the anode and also how it changes during electrochemical redox cycling. The understanding of the sodium storage mechanism is improved by the favorable results, which also offer insights for developing high-performance electrode materials for rechargeable SIBs.

7.
Dalton Trans ; 52(26): 9131-9137, 2023 Jul 04.
Artigo em Inglês | MEDLINE | ID: mdl-37340854

RESUMO

The recent trend in research fosters the use of abundant seawater for modifying metal surfaces as electrode materials for energy generation, storage, transport, and water-splitting technologies. Economic and ecofriendly seawater is used as a solvent for modifying the surface of 3D nickel-foam (NiF) to Na2O-NiCl2@NiF as an electrode material in electrochemical supercapacitors and water-splitting electrocatalysis applications. The phase of the as-obtained Na2O-NiCl2 is confirmed from the proposed reaction mechanism, followed various physical measurement tests such as X-ray photoelectron spectroscopy and Fourier transform infrared analysis. The formation of Na2O-NiCl2 is caused by a high operation temperature and pressure of seawater solvent, the presence of lone pair electrons on oxygen, and more reactivity of Na for combining with dissolved oxygen than the lone-pair free Cl (towards Ni). In addition to exceptional HER and OER electrocatalytic activities, i.e., 146.3 mV cm-2 and 217 mV cm-2 at a scan rate of 5 mV s-1 to attain the 10 mA cm-2 current density, the Na2O-NiCl2 has demonstrated moderate energy storage ability with considerable durability, i.e., 2533 F g-1 specific capacitance at 3 A g-1 current density even after 2000 redox cycles. The as-assembled Na2O-NiCl2//Na2O-NiCl2 symmetric electrochemical supercapacitor device has ignited a "CNED" panel consisting of nearly forty LEDs with full brightness, offering applied importance in home appliances. In nutshell, seawater-modified metal surfaces can be used for energy storage and water-splitting applications.

8.
Int J Biol Macromol ; 244: 125384, 2023 Jul 31.
Artigo em Inglês | MEDLINE | ID: mdl-37330101

RESUMO

The pad dry cure method was used to coat linen fibers with a smart nanocomposite that has photoluminescence, electrical conductivity, flame resistance, and hydrophobic properties. Environmentally benign silicone rubber (RTV) was utilized to encapsulate rare-earth activated strontium aluminate nanoparticles (RESAN; 10-18 nm), polyaniline (PANi) and ammonium polyphosphate (APP) into linen surface. The flame resistance of the treated linen fabrics was evaluated for their self-extinguishing capabilities. The flame-retardant qualities of linen were retained for 24 washings. Additionally, the superhydrophobicity of the treated linen has markedly improved upon increasing the concentration of RESAN. The colorless luminous film deposited onto linen surface was excited at 365 nm and emitted a wavelength of 518 nm. In accordance with the results of CIE (Commission internationale de l'éclairage) Lab and luminescence analysis, the photoluminescent linen gave rise to diverse colors, including off-white in daylight, green beneath UV radiation and greenish-yellow in a darkened room. The treated linen displayed sustained phosphorescence, as evidenced by decay time spectroscopy. The bending length and air permeability of linen were evaluated for their mechanical and comfort assessment. Finally, the coated linens exhibited remarkable antibacterial activity along with strong UV protection.


Assuntos
Retardadores de Chama , Nanocompostos , Celulose/química , Estrôncio , Nanocompostos/química , Condutividade Elétrica
9.
Anal Chim Acta ; 1251: 341016, 2023 Apr 22.
Artigo em Inglês | MEDLINE | ID: mdl-36925274

RESUMO

The rapid-charge carrier recombination and low conductivity are critical in devising an efficient photoelectrochemical (PEC) sensor. Herein, we propose partial oxidation of few-layered MXene (Ti3C2Tx) to construct a photo-active TiO2/Ti3C2Tx platform that could be configured for PEC sensing of folate receptors (FR), particularly, FR-expressing breast cancer cells (MDA-MB-231). MXene-Ti3C2Tx dispersion was oxidized in natural-open air conditions, where continuous exposure for six (06) days allowed for homogeneous in-situ growth of TiO2 over MXenes nanosheets (MX-06). This exposure enabled partial oxidation of MXene-sheets with a balanced TiO2 to MXene content that could exhibit improved photoresponsive characteristics owing to the synergism of redox-active TiO2 and highly conductive underlying Ti3C2Tx. The photoelectrode was then adapted for biorecognition by conjugating chitosan and folic acid (FA) networks, which permitted selective detection of FR-expressed cells with significant antifouling capabilities against common proteins such as bovine serum album (BSA), hemoglobin, and immunoglobulin G. (Ig G). The detection mechanism relies on FA's strong affinity for cancer cell folate receptors, which proportionally inhibited the photoelectrodes PEC oxidation response to ascorbic acid (AA)(mediator). The proposed inhibition strategy enabled sensitive detection of FR-expressed MDA-MB-231 cells in the concentration range of 1 × 102 to 2 × 107 cells/mL with a detection limit of 1.01 cells/mL (S/N = 3).


Assuntos
Neoplasias , Titânio , Oxirredução , Ácido Fólico
10.
Dalton Trans ; 52(9): 2735-2748, 2023 Feb 28.
Artigo em Inglês | MEDLINE | ID: mdl-36749193

RESUMO

We present the combustion-based synthesis of BiFeO3 (BFO) and Gd:BiFeO3 perovskite nanoparticles. XRD analysis demonstrates that the undoped BFO (x = 0) perovskite sample shows a single perovskite phase with a rhombohedral structure. However, increase in the Gd3+ content from x = 0.05 and 0.15 to 0.25 led to the occurrence of a structural phase transformation from rhombohedral (BiFeO3) to orthorhombic (Bi2Fe4O9). With an increase in the Gd-dopant the average crystallite size of rhombohedral structures increased from 16 to 23 nm. The perovskite samples were examined using XPS, which confirmed the presence of Bi3+, Gd3+, Fe2+, and O2+ ions. FT-IR spectroscopy indicated the existence of elemental functional groups in the synthesized perovskite nanoparticles. Furthermore, the direct band gap measured by DRS reduced from 2.16 to 2.0 eV as the Gd concentration increased. The nanoparticles of the BFO perovskite had an uneven shape, a tendency to agglomerate, and fused grains with defined grain boundaries. At ambient temperature, both the undoped and Gd:BFO perovskite nanoparticles exhibit a ferromagnetic characteristic. It was found that the BET surface area of the undoped and Gd-doped BFO perovskite nanoparticles varied progressively from 4.38 to 33.52 m2 g-1. The catalytic oxidation studies conducted in a batch reactor under air conditions revealed that the synthesized catalysts, in particular, Gd:BFO (x = 0.25), exhibited higher conversion and selectivity efficiencies for glycerol (con. 100% and sel. 99.5%, respectively).

11.
J Colloid Interface Sci ; 633: 886-896, 2023 Mar.
Artigo em Inglês | MEDLINE | ID: mdl-36495810

RESUMO

Potassium-ion batteries (KIBs) are promising energy storage devices owing to their low cost, environmental-friendly, and excellent K+ diffusion properties as a consequence of the small Stoke's radius. The evaluation of cathode materials for KIBs, which are perhaps the most favorable substitutes to lithium-ion batteries, is of exceptional importance. Manganese dioxide (α-MnO2) is distinguished by its tunnel structures and plenty of electroactive sites, which can host cations without causing fundamental structural breakdown. As a result of the satisfactory redox kinetics and diffusion pathways of K+ in the structure, α-MnO2 nanorods cathode prepared through hydrothermal method, reversibly stores K+ at a fast rate with a high capacity and stability. It has a first discharge capacity of 142 mAh/g at C/20, excellent rate execution up to 5C, and a long cycling performance with a demonstration of moderate capacity retention up to 100 cycles. X-ray diffraction (XRD), X-ray photoelectron spectroscopy (XPS), and density functional theory (DFT) simulations confirm that the K+ intercalation/deintercalation occurs through 0.46 K movement between MnIV/MnIII redox pairs. First-principles density functional theory (DFT) calculations predict a diffusion barrier of 0.31 eV for K+ through the 1D tunnel of α-MnO2 electrode, which is low enough to promote faster electrochemical kinetics. The nanorod structure of α-MnO2 facilitates electron conductive connection and provides a strong electrode-electrolyte interface for the cathode, resulting in a very consistent and prevalent execution cathode material for KIBs.

12.
Nanomaterials (Basel) ; 12(19)2022 Sep 27.
Artigo em Inglês | MEDLINE | ID: mdl-36234507

RESUMO

Herein, aqueous ammonium sensing characteristics of polyvinylpyrrolidone (PVP) capped silver nanoparticles (Ag-NPs) coated optical fiber-based sensors are presented. The PVP-capped Ag-NPs were prepared using cold and modified polyol synthesis methods. Aqueous ammonium detection was carried out by the surface plasmon resonance (SPR) effect observed in the Ag-NPs coated optical fiber system. The effect of cold and modified polyol synthesis methods on optical sensing performance was studied. The optical fiber cladding was modified with PVP-capped Ag-NPs according to the standard protocol for sensing investigation. The probe sensing response was analyzed for varying concentrations of ammonium ions on red, green, and blue LEDs. The sensor characteristics, viz., sensing response, repeatability, calibration curve, and ambient light effect, were investigated for PVP capped Ag-NPs coated optical fiber-based sensor. The PVP capped Ag-NPs synthesized via the polyol synthesis method showed a detection limit of 48.9 mM, 1.33 mV/M sensitivity, and an excellent linear relationship (R2 = 0.9992) between voltage and ammonium ion concentration in the range of 0.054-13.4 M concentration. On the other hand, PVP capped Ag-NPs synthesized using the cold synthesis method showed a detection limit of 159.4 mM, a sensitivity of 0.06 mV/M, and a poor linear relationship (R2 = 0.4588) between voltage and ammonium ion concentration in the range of 0.054-13.4 M concentration. The results indicate that the PVP-capped Ag-NPs synthesized using the polyol synthesis method exhibit enhanced ammonium ion sensing compared to the cold synthesis method.

13.
Sensors (Basel) ; 22(11)2022 May 31.
Artigo em Inglês | MEDLINE | ID: mdl-35684819

RESUMO

Ganoderma lucidum mushroom-mediated green synthesis of nanocrystalline titanium dioxide (TiO2) is explored via a low-temperature (≤70 °C) wet chemical method. The role of Ganoderma lucidum mushroom extract in the reaction is to release the ganoderic acid molecules that tend to bind to the Ti4+ metal ions to form a titanium-ganoderic acid intermediate complex for obtaining TiO2 nanocrystallites (NCs), which is quite novel, considering the recent advances in fabricated gas sensing materials. The X-ray powder diffraction, field emission scanning electron microscopy, Raman spectroscopy, and Brunauer-Emmett-Teller measurements etc., are used to characterize the crystal structure, surface morphology, and surface area of as-synthesized TiO2 and Pd-TiO2 sensors, respectively. The chlorine (Cl2) gas sensing properties are investigated from a lower range of 5 ppm to a higher range of 400 ppm. In addition to excellent response-recovery time, good selectivity, constant repeatability, as well as chemical stability, the gas sensor efficiency of the as-synthesized Pd-TiO2 NC sensor is better (136% response at 150 °C operating temperature) than the TiO2 NC sensor (57% at 250 °C operating temperature) measured at 100 ppm (Cl2) gas concentration, suggesting that the green synthesized Pd-TiO2 sensor demonstrates efficient Cl2 gas sensing properties at low operating temperatures over pristine ones.


Assuntos
Cloro , Venenos , Temperatura , Titânio/química
14.
Materials (Basel) ; 15(9)2022 Apr 26.
Artigo em Inglês | MEDLINE | ID: mdl-35591460

RESUMO

We present a simplistic, ultrafast, and facile hydrothermal deposition of ternary Cu2SnS3 nanoparticles (CTS NPs). The fabricated CTS NPs show superior antimicrobial and photocatalytic activities. In the presence of UV-Visible illumination, methylene blue (MB) dye was studied for photocatalytic dye degradation activity of CTS NPs. Excellent efficiency is shown by incorporating CTS NPs to degrade MB dye. There is a ~95% decrease in the absorbance peak of the dye solution within 120 min. Similarly, CTS NPs tested against three bacterial strains, i.e., B. subtilis, S. aureus, P. vulgaris, and one fungal strain C. albicans, defining the lowest inhibitory concentration and zone of inhibition, revealed greater antimicrobial activity. Hence, it is concluded that the CTS NPs are photocatalytically and antimicrobially active and have potential in biomedicine.

16.
ACS Omega ; 6(19): 12623-12630, 2021 May 18.
Artigo em Inglês | MEDLINE | ID: mdl-34056413

RESUMO

The organic and eco-friendly materials are extended to prevail over the worldwide energy crisis where bio-inspired carbonaceous electrode materials are being prepared from biogenic items and wastes. Here, coconut water is sprayed over three-dimensional (3D) nickel foam for obtaining a carbonaceous electrode material, i.e., C@Ni-F. The as-prepared C@Ni-F electrode has been used for structural elucidation and morphology evolution studies. Field emission scanning electron microscopy analysis confirms the vertically grown nanosheets of the C@Ni-F electrode, which is further employed in the oxygen evolution reaction (OER) and hydrogen evolution reaction (HER), where excellent OER and HER performances with small overpotentials of 219 and 122 mV and with stumpy Tafel slopes, i.e., 27 and 53 mV dec-1, are respectively obtained, suggesting a bifunctional potential of the sprayed electrode material. Moreover, sustainable bifunctional performance of C@Ni-F proves considerable chemical stability and moderate mechanical robustness against long-term operation, suggesting that, in addition to being a healthy drink to mankind, coconut water can also be used for water splitting applications.

17.
Talanta ; 230: 122292, 2021 Aug 01.
Artigo em Inglês | MEDLINE | ID: mdl-33934764

RESUMO

Exposure to colorless ammonia gas may lead to damage in human organs or even death. Herein, we describe facile fabrication of an environmentally-friendly, portable, reversible, and sensitive solid-state colorimetric cellulose (Cell)/anthocyanin (Anth) vapochromic sensor that exhibits instant visual color change to both gaseous and aqueous phases of ammonia. The naturally occurring anthocyanin can be easily extracted from the red-cabbage plant and applied as a direct dyestuff onto viscose fibers in the presence of potassium aluminum sulfate as mordant to generate nanoparticles of mordant/anthocyanin coordinated complex. Thus, upon exposure to aqueous ammonia, an instant color change of the smart (Cell-Anth) diagnostic assays, from purple to colorless, was noted and quantitatively probed via both CIE Lab coordinates and UV-Vis spectral measurements. Importantly, the fabricated (Cell-Anth) viscose fabric showed rapid responses, fraction of second, with a good limit of detection (LOD) in the range of 200-1200 mg L-1. This receptor also demonstrated ratiometric changes in the UV-Vis absorbance spectra, giving a hypsochromic shift from 611 to 375 nm upon increasing the total content of ammonia in an aqueous media. The morphologies of Cell-Anth fabrics as well as particle size of the generated mordant/dye complex on the fabric surface have been characterized by transmission electron microscopic (TEM), scan electron microscopy (SEM), energy-dispersive X-ray patterns (EDX) and Fourier-transform infrared spectroscopic (FT-IR). The comfortability of the dyed cellulose fibers was also investigated in terms of their bend length, air-permeability and colorfastness properties. Significantly, the present study offers a promising onsite vapochromic device that enables detection of ammonia in either aqueous or gas phase in various environments and products.

18.
Small ; 17(20): e2007994, 2021 05.
Artigo em Inglês | MEDLINE | ID: mdl-33749108

RESUMO

Rhenium is one of the most valuable elements found in nature, and its capture and recycle are highly desirable for resource recovery. However, the effective and efficient collection of this material from industrial waste remains quite challenging. Herein, a tetraphenylmethane-based cationic polymeric network (CPN-tpm) nanotrap is designed, synthesized, and evaluated for ReO4- recovery. 3D building units are used to construct imidazolium salt-based polymers with positive charges, which yields a record maximum uptake capacity of 1133 mg g-1 for ReO4- collection as well as fast kinetics ReO4- uptake. The sorption equilibrium is reached within 20 min and a kd value of 8.5 × 105 mL g-1 is obtained. The sorption capacity of CPN-tpm remains stable over a wide range of pH values and the removal efficiency exceeds 60% for pH levels below 2. Moreover, CPN-tpm exhibits good recyclability for at least five cycles of the sorption-desorption process. This work provides a new route for constructing a kind of new high-performance polymeric material for rhenium recovery and rhenium-contained industrial wastewater treatment.


Assuntos
Rênio , Ânions , Polímeros , Águas Residuárias
19.
ACS Appl Mater Interfaces ; 13(9): 11433-11441, 2021 Mar 10.
Artigo em Inglês | MEDLINE | ID: mdl-33630568

RESUMO

Sodium-ion batteries (SIBs) can develop cost-effective and safe energy storage technology for substantial energy storage demands. In this work, we have developed manganese oxide (α-MnO2) nanorods for SIB applications. The crystal structure, which is crucial for high-performance energy storage, is examined systematically for the metal oxide cathode. The intercalation of sodium into the α-MnO2 matrix was studied using the theoretical density functional theory (DFT) studies. The DFT studies predict Na ions' facile diffusion kinetics through the MnO2 lattice with an attractively low diffusion barrier (0.21 eV). When employed as a cathode material for SIBs, MnO2 showed a moderate capacity (109 mAh·g-1 at C/20 current rate) and superior life cyclability (58.6% after 800 cycles) in NaPF6/EC+DMC (5% FEC) electrolyte. It shows a much higher capacity of 181 mAh·g-1 (C/20 current rate) in NaClO4/PC (5% FEC) electrolyte, though it suffers fast capacity fading (11.5% after 800 cycles). Our findings show that high crystallinity and hierarchical nanorod morphology of the MnO2 are responsible for better cycling performance in conjunction with fast and sustained charge-discharge behaviors.

20.
Dalton Trans ; 50(6): 2032-2041, 2021 Feb 14.
Artigo em Inglês | MEDLINE | ID: mdl-33480909

RESUMO

Tungsten oxide (WO3) as an efficient heterogeneous catalyst was prepared via a simple hydrothermal route for the synthesis of a wide range of bioactive heterocyclic compounds. The present investigation deals with the rapid and low-cost synthesis of C-3-alkylated 4-hydroxycoumarin, chromene, and xanthene derivatives. WO3 nanorods (NRs) are successfully envisaged to catalyze desired transformations, demonstrating the wide range of their potential applications in catalysis. Synthetic transformation details, smallest catalytic amounts, excellent product yields, and plausible reaction mechanisms for the formation of these heterocyclic scaffolds are elicidated. As-prepared WO3 NRs are characterized to confirm their structural, chemical, and morphological parameters by X-ray diffraction, X-ray photoelectron spectroscopy, and field emission scanning electron microscopy measurements, respectively. We discuss the factors that govern the formation of products, and the active role of WO3 NRs, which are essential for the activation of substrates in the present study of thermal conditions. Herein, detailed synthesis and spectroscopic information of the prepared compounds are reported.


Assuntos
Compostos Heterocíclicos/química , Nanotubos/química , Óxidos/química , Tungstênio/química , Catálise , Química Verde , Porosidade , Propriedades de Superfície
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