Sharif Digital Repository

In this study, the effects of unmodified calcium zinc phosphate (UCZP) and modified calcium zinc phosphate (MCZP) nanopigments (NPs) on the rheological, mechanical, and corrosion protection performance (CPP) of the epoxy (EP) coatings were investigated. Transmission electron microscopy (TEM) coupled with energy-dispersive X-ray spectroscopy (EDS) and X-ray photoelectron spectroscopy (XPS) were used to study morphology and overall chemical structure of synthesized calcium zinc phosphate (CZP) NPs, respectively. The grafting of methyltriethoxysilane (MTES) molecules on the surface of CZP was assessed using Fourier transform infrared spectroscopy (FT-IR), thermogravimetric analysis (TGA), and... 

Here, a solution combustion method was employed to construct a photoanode based on bismuth vanadate (BV) composition. To curtail the fast charge recombination, phosphorus-doped g-C3N4 nanosheets (PCNS) in combination with BV are considered a potential approach. The prepared solution combustion facilitated the formation of a BiVO4-PCNS (BV-PCNS) hybrid photoanode with worm-like morphology with a simple setup. The weight ratio of PCNS/BiVO4 and the loading volume/cm2 were optimized to determine the most efficient photoanode. The highest photocurrent density of 0.5 mA/cm2 at 1.23 V vs reversible hydrogen electrode (RHE) under 1 sun illumination was achieved for the hybrid nanostructure at 2 wt... 

Exploring bi-functional electrocatalysts with excellent activity, good durability, and cost-effectiveness for electrochemical hydrogen and oxygen evolution reactions (HER and OER) in the same electrolyte is a critical step towards a sustainable hydrogen economy. Three main features such as high density of active sites, improved charge transfer, and optimized electronic configuration have positive effects on the electrocatalyst activity. In this context, understanding structure–composition–property relationships and catalyst activity is very important and highly desirable. Herein, for the first time, we present the design and fabrication of novel MOF-derived ultra-small Ru/RuO2 nanoparticles... 

With the advent of the Internet of Things (IoT), the development of self-powered sensors has received much attention. Introducing triboelectric nanogenerators (TENGs) as a power source that converts mechanical movement into electrical signals has been admired recently. Moreover, the monitoring of humidity has become enormously essential in several technological contexts from environment monitoring to biomedical applications, thus joining these two subjects provides a huge benefit in achieving self-powered humidity sensors. Here, in this research, facile, low-priced and self-powered humidity sensors are fabricated utilizing transition-metal dichalcogenides (TMD) nanosheets. Semi-vertical SnS2... 

Although hematite (i.e., α-Fe2O3) has been widely investigated in photoelectrochemical water oxidation studies due to its high theoretical photocurrent density, it still suffers from serious surface charge recombination and low photoelectrochemical stability. Here we report an in situ electrochemical method to form a uniform and ultrathin (i.e., 3-5 nm) passivation layer all over the pores of an optimized ∼3.2% Ti-doped α-Fe2O3 photoanode. We unveil the amorphous and defective nature of the in situ derived layer assigned to a high concentration of oxygen vacancies and intercalated potassium atoms there, i.e., the formation of Ti/K co-doped defective α-Fe2O3−x. Owing to the efficient... 

Porphyrin-POM hybrid materials with excellent NLO properties are supposed to be a worthy entrant for forthcoming telecommunication, optical fibers, optical data storage and optical limiting devices, but due to adverse solubility problems, they are replaced by polymeric materials. Herein, we assessed third order NLO and second hyperpolarizability of porphyrin-polyimide compounds (NH-PI and Zn-PI) synthesized from the reaction of 4,4ʹ-hexafluoroisopropylidene-diphthalic anhydride (6FDA) with C44H32N6 (NH-DATPP) and C44H30N4Zn (Zn-DATPP) porphyrins under ambient conditions. The Z-scan measurement of these compounds revealed reverse saturation absorption as well as self-defocusing performance.... 

In this contribution, spinel MgAl2O4 nanospheres prepared by the combustion method were coupled with thermally-exfoliated g-C3N4 nanosheets (TE-GCN) through an efficient isoelectric point-assisted calcination technique. Physical characteristics of the synthesized nanocomposite were understudied utilizing the XRD, FT-IR, FE-SEM, TEM, BET-BJH, UV–Vis DRS, PL, and EIS analyses. This material was used as a novel nano-photocatalyst for degradation of reactive red 195 (RR195) industrial dye contaminant. Results revealed that, a successful synthesis of a heterojunction between the components of the nanocomposite was achieved. This exhibited an enormously improved electron-hole separation leading to... 

Cu2ZnSnS4 (CZTS) is a good candidate for cost-effective perovskite solar cells (PSCs) due to its direct bandgap with a value of 1.4–1.5 eV. In this study, we investigate CZTS ink as an inorganic hole-transport-layer (HTL) in CsMAFAPbIBr mixed halide PSCs. We study the cell efficiency and hole extraction from the perovskite layer for different thicknesses of HTL. The optimized device exhibits better hole selectivity, and the best efficiency of the device (12.84%) is achieved for the CZTS layer with a thickness of 159 nm. The prepared samples were also tested by open-circuit voltage decay analysis and electrochemical impedance spectroscopies. Results show that the optimized device effectively... 

Active edge sites of MoS2 nanosheets exhibit promising futures for hydrogen evolution reaction (HER), comparable with remarkable performances of highly cost platinum. However, 3D structures of MoS2 suffer from a lack of high mobility and unexposed active sites which lower the electrocatalytic activity. In this study, we show that there is a balance between increasing the active sites on the one hand and managing the charge transfer to facilitate the reaction on the other hand, and achieving this balance increases the efficiency of the electrocatalyst tremendously. For this purpose, we directly attached exfoliated MoS2 nanosheets onto carbon cloth (CC) substrate as a 3D network of conductive... 

We report on charge transport across self-assembled monolayers (SAMs) of short tau peptides by probing the electron tunneling rates and quantum mechanical simulation. We measured the electron tunneling rates across SAMs of carboxyl-terminated linker molecules (C6H12O2S) and short cis-tau (CT) and trans-tau (TT) peptides, supported on template-stripped gold (AuTS) bottom electrode, with Eutectic Gallium-Indium (EGaIn)(EGaIn) top electrode. Measurements of the current density across thousands of AuTS/linker/tau//Ga2O3/EGaIn single-molecule junctions show that the tunneling current across CT peptide is one order of magnitude lower than that of TT peptide. Quantum mechanical simulation... 

Hematite is recognized as a promising photoanode for photoelectrochemical water oxidation to produce solar hydrogen due to its favorable properties. However, the high charge carrier recombination rate due to low electrical conductivity and sluggish oxygen reduction kinetics of pure hematite hinder its photocatalytic activity. This work proposed a new hematite-based heterostructure of Ti-Fe2O3/Fe2TiO5/FeOOH, synthesized through a hydrothermal method. The photoanode morphology was branched nanorods that expanded their surface area and improved charge transfer at the photoanode/electrolyte interface. In a novel and complement modification approach, a thin pseudobrookite interlayer was applied... 

Different polymers have been already introduced for passivating the interfacial defects at the interface of perovskite and the organic hole transport material, meanwhile as an environmental barrier in perovskite solar cells (PSCs). Herein, polyvinylcarbazole (PVK) compared to polymethylmethacrylate (PMMA) at the interface of the perovskite (Cs0.05(MA0.83FA0.17)0.95Pb(Br0.17I0.83)3) layer and CuInS2/carbon as a low-cost inorganic hole-collecting electrode are investigated. By suppressing interfacial recombination using PMMA and PVK, saturation current density (in dark current) decreases one order of magnitude from 7.9 × 10−10 to 4.0 × 10−11 mA cm−2 by adding PMMA and two orders of magnitude... 

A cost-effective, durable, and easy-to-produce improvement in bifunctional electrocatalysts for water splitting is crucial for future renewable energy systems. In this present study, shape-controlled one-dimensional (1D) phosphorized cobalt (CoP) on 3D porous nickel foam (NiF) was synthesized through successive treatment of commercial NiF with acetone and ethanol, followed by hydrothermal growth of Co and final process of phosphorization by thermochemical reactions. The evaluations of products proved reduced overpotential (270 mV at 10 mA. cm−2 for hydrogen evolution reaction (HER) process and a low overpotential of 320 mV to reach a high current density of 20 mA. cm−2), low Tafel slope... 

Organic-inorganic halide perovskites (OIHPs) have emerged as a promising semiconductor for the fabrication of efficient optoelectronic devices such as photodetectors (PDs). Among all the perovskite compositions, the mixed-halide MAPb(BrxI1-x)3 formulations have gained more attention for photodetection application thanks to their tunable optoelectronic properties and great stability. However, there is still a lack of sufficient understanding of the effect of Br doping on the stability and physical properties of MAPb(BrxI1-x)3 based PDs. In this work, we prepare a series of MAPb(BrxI1-x)3 (x = 0, 0.04, 0.08, 0.12, and 0.16) single crystals (SCs) and investigate the influence of the Br content... 

This study demonstrates the glucose-template assisted synthesis of hydrogen-treated Pt: TiO2/WO3 composites, and their round-the-clock photoactivity towards methanol (MeOH) degradation under light illumination and in dark. XRD indicated increasing rutile fraction in TiO2 as a function of template removal, WO3 crystallinity and H2 treatment process. The presence of oxygen vacancies in WO3 was confirmed by XPS. Lower recombination rate and higher surface area were observed in the optimized H2-Pt-G:TiO2/WO3 catalyst. The presence of oxygen vacancies and optical enhancements due to the synergistic interactions of the multi-system (TiO2, WO3 and Pt) extended the visible light absorption of the... 

Semiconductor-based photocatalysis is an efficient approach for degradation of organic pollutants. In this context, ZnO/g-C3N4 composite nanofibers containing carbonaceous species with different concentrations of g-C3N4 nanosheets (x = 0.25, 0.5, 1, 2, 10 wt%) noted as ZnO/carbon/(x wt%) g-C3N4 are prepared by electrospinning technique. For preparation of the composite nanofibers, bulk g-C3N4 is exfoliated to nanosheets, and then it is mixed with polyvinyl alcohol and appropriate zinc acetate content followed by electrospinning process. Thermal annealing of the as spun zinc acetate/poly(vinyl alcohol)/g-C3N4 nanosheets sample under N2 atmosphere leads to the formation of carbonaceous species... 

A new magnetic quaternary photocatalyst, K4Nb6O17/α-Fe2O3/Fe3N/g-C3N4, was synthesized via a simple one-step thermal pyrolysis process. The prepared photocatalyst was well characterized, and its photocatalytic activity was evaluated towards acetamiprid pesticide degradation, CO2 reduction reaction, and U87-MG cell eradication. The coexistence of four different crystalline structures in the prepared photocatalyst could simultaneously facilitate photoelectron transport and suppress charge recombination through their coupled heterogeneous interfaces. Because of the coexistence of various photosensitive compounds, the prepared photocatalyst showed the excellent capability to harvest the visible... 

In this article, the novel concept of using magnetic nanofluidic electrolyte for redox flow batteries is demonstrated for the first time. In this regard, the stable magnetic nanofluidic electrolytes are prepared by dispersing magnetic modified multiwalled carbon nanotubes (MMWCNTs) in the positive electrolyte of a polysulfide-iodide redox flow battery at mass concentrations of less than 0.3 g L−1. The electrochemical behavior of magnetic nanofluidic electrolyte was examined using cyclic voltammetry at different mass concentrations of MMWCNTs with a carbon felt electrode. Higher and stable peak current densities were observed at larger mass concentrations of MMWCNTs. A polysulfide-iodide... 

Active edge sites of MoS2 nanosheets exhibit promising futures for hydrogen evolution reaction (HER), comparable with remarkable performances of highly cost platinum. However, 3D structures of MoS2 suffer from a lack of high mobility and unexposed active sites which lower the electrocatalytic activity. In this study, we show that there is a balance between increasing the active sites on the one hand and managing the charge transfer to facilitate the reaction on the other hand, and achieving this balance increases the efficiency of the electrocatalyst tremendously. For this purpose, we directly attached exfoliated MoS2 nanosheets onto carbon cloth (CC) substrate as a 3D network of conductive... 

In our previous report (J. Phys. Org. Chem., 2017), we discussed the dual behavior of gold nanocluster (Au3 NC), where it scavenged reactive oxygen species (ROS) while promoted their generation to a lesser extent. Continuing this quest, we investigate the effects of Au3 NC on common reactive nitrogen species (RNS: O=N˙ and O=N-O) and their precursors (O=N-H and O=N-O-H, respectively), at B3LYP/LACVP+* level of theory. We compare the results with those of prevalent ROS (H-O˙ and H-O-O˙) and their precursors (H-O-H and H-O-O-H, respectively). To this end, various parameters are probed such as binding energy (Eb), bond dissociation energy (BDE), bond lengths, Mullikan spin density (MSD),...