Graphene-based materials modified with transition metals, and their potential utilization as hydrogen storage devices, are extensively studied in the last decades. Despite this widespread interest, a comprehensive understanding of the intricate interplay between graphene-based transition metal systems and H2 molecules remains incomplete. Beyond fundamental H2 adsorption, the activation of H2 molecule, crucial for catalytic reactions and hydrogenation processes, may occur on the transition metal center. In this study, binding modes of H2 molecules on the circumcoronene (CC) decorated with Cr or Fe atoms are investigated using the DFT methods. Side-on (η2-dihydrogen bond), end-on and dissociation modes of H2 binding are explored for high (HS) and low (LS) spin states. Spin state energetics, reaction energies, QTAIM and DOS analysis are considered. Our findings revealed that CC decorated with Cr (CC-Cr) emerges as a promising material for H2 storage, with the capacity to store up to three H2 molecules on a single Cr atom. End-on interaction in HS is preferred for the first two H2 molecules bound to CC-Cr, while the side-on LS is favored for three H2 molecules. In contrast, CC decorated with Fe (CC-Fe) demonstrates the capability to activate H2 through H–H bond cleavage, a process unaffected by the presence of other H2 molecules in the vicinity of the Fe atom, exclusively favoring the HS state. In summary, our study sheds light on the intriguing binding and activation properties of H2 molecules on graphene-based transition metal systems, offering valuable insights into their potential applications in hydrogen storage and catalysis.

The interface area of the face sheet and core of the sandwich composite is seen as a weakness due to its low de-bonding toughness. To overcome this concern, it is critical to develop a suitable modification strategy to enhance the de-bonding toughness of the face sheet/core interface. In the present study, the corrugated core reinforced sandwich composite was prepared through co-curing and secondary bonding approaches. The MWCNTs reinforced adhesive was induced in the face sheet/core interface in different weight concentrations. The MWCNT-reinforced adhesive was prepared using the sonication technique, and its dispersion was examined using atomic force microscopy (AFM). The three-point bending test revealed that sandwich composite prepared using the co-cure method has higher flexural strength than secondary bonded samples due to better bonding face sheet and corrugated core. Compared with MWCNT-free corrugated core reinforced co-cured sandwich composites (CCSC), the flexural strength of 1 wt.% MWWCNT-induced sandwich composite was increased by 101.28%. The microstructural study showed that secondary bonded samples had extensive fibre breakage at the face plate due to early de-bonding of the face sheet and corrugated core. Furthermore, the free vibrational analysis was performed to evaluate the natural frequency and damping values of the corrugated core reinforced sandwich composite. The modal test results indicated that inducing 1wt.% MWCNTs in the face sheet/core interface had enhanced the natural frequencies of co-cured sandwich composites. The present study provides a suitable method to address the weaker de-bonding toughness concerns of face sheet/core interface region of sandwich structures.

Exploring highly efficient, and low-cost oxygen reduction reaction (ORR) and oxygen evolution reaction (OER) catalysts is extremely vital for the commercial application of advanced energy storage and conversion devices. Herein, a series of graphene-like C2N supported TMx@C2N, (TM = Fe, Co, Ni, and Cu, x = 1, 2) single- and dual-atom catalysts are designed. Their catalytic performance is systematically evaluated by means of spin-polarized density functional theory (DFT) computations coupled with hydrogen electrode model. Regulating metal atom and pairs can widely tune the catalytic performance. The most promising ORR/OER bifunctional activity can be realized on Cu2@ C2N with lowest overpotential of 0.46 and 0.38 V for ORR and OER, respectively. Ni2@ C2N and Ni@C2N can also exhibit good bifunctional activity through effectively balancing the adsorption strength of intermediates. The correlation of reaction overpotential with adsorption free energy is well established to track the activity and reveal the activity origin, indicating that catalytic activity is intrinsically governed by the adsorption strength of reaction intermediates. The key to achieve high catalytic activity is to effectively balance the adsorption of multiple reactive intermediates by means of the synergetic effect of suitably screened bimetal atoms. Our results also demonstrate that lattice strain can effectively regulate the adsorption free energies of reaction intermediates, regarding it as an efficient strategy to tune ORR/OER activity. This study could provide a significant guidance for the discovery and design of highly active noble-metal-free carbon-based ORR/OER catalysts.

We report a new route of akaganéite (β-FeOOH) formation and maghemite (γ-Fe2O3) formation. Akaganéite can be produced by stirring Fe2+ at room temperature for a day under mild conditions. We used FeCl2 ·4H2O as the precursor and mixed it with the Na-rich particle from the oxidation debris solution. The role of the concentration ratio between graphene oxide (GO) and NaOH was addressed to generate oxidation debris (OD) on the surface. In particular, the characterization of OD by transmission electron microscope (TEM) imaging provides clear evidence for the crystal formation of Na-rich particle under electron beam irradiation. For the base treatment process, increasing the concentration of a NaOH in Na-rich solution contributed primarily to the formation of γ-Fe2O3. The characterization by scanning electron microscope (SEM) and TEM showed that the morphology was changed from needle-like to small-oval form. In addition, β-FeOOH can be effectively produced directly using GO combined with FeCl2 ·4H2O at room temperature. More specifically, the role of parent material (Hummer's GO and Brodie's GO) was discussed, and the crystal transformation was identified. Our results concluded that β-FeOOH can be formed in basic and acidic conditions.

We have intended and preparation of hierarchically absorbent materials were covered with a NiMn2O4 and acts as a catalyst for azo dye degradation. The polyaromatic-based (PA) absorbent compounds were initially constructed by bromomethylated aromatic hydrocarbons which undergo self-polymerization in presence of ZnBr as a reagent and cross linker is bromomethyl methyl ether. The absorbent black materials with a 3D network were prepared by direct carbonization and activation of the as-prepared PA. The hydrothermal method was adapted for the preparation of carbon hybrid material C@NiMn2O4 powder's catalytic activity is effective in reducing p-nitrophenol to p-aminophenol and decolorizing carbon-based dyes like methyl orange (MO), methyl yellow (MY), and Congo red (CR) in aqueous media at 25 °C when NaBH4 is added. UV–visible spectroscopy was used to analyze the dyes' breakdown at regular interval.

Integration of noble metals on graphene is renowned for their catalytic and antioxidant prowess. However, utilization of toxic chemicals in the synthesis creates environmental pollution and poisonous nature of chemically synthesized materials. To address this, an economical and eco-friendly method for synthesizing graphene-gold (BRG-Au) nanocomposite by anchoring gold nanoparticles (Au NPs) onto reduced graphene oxide sheets using betel leaf extract as a reducing and stabilizing agent is presented. Comprehensive structural characterizations through UV–Visible, Raman, FT-IR, and XRD analyses confirm the successful formation of the BRG-Au nanocomposite. Morphological assessments utilizing FE-SEM and TEM techniques revealed the presence of transparent, twinkling graphene sheets embellished with 20 to 60 nm of Au NPs in various shapes, including spherical, triangular, pentagonal, circular, and trapezoids. The catalytic and antioxidant activities of the BRG-Au nanocomposite were thoroughly evaluated. In catalytic trials, the nanocomposite exhibited remarkable efficiency in the reduction of 4-nitrophenol to 4-aminophenol, accomplishing this transformation within a mere 30 min during the initial cycle and maintaining stable catalytic performance over three consecutive cycles. Additionally, antioxidant analyses employing Total Antioxidant Activity and 2,2-diphenyl-1-picrylhydrazyl methods demonstrated that BRG-Au nanocomposite possessed equal or superior antioxidant activity than the ascorbic acid standard. This research thus underscores the promising potential of environmentally benign synthesis method for graphene-gold nanocomposite with enhanced catalytic and antioxidant properties.

In the current study, the epoxy material was mixed with 10%, and 30% weight percent carbon material as filler in different thicknesses (1 cm, 1.5 cm, and 2 cm). Transmission electron microscope (TEM) measurements showed the average size of the nano-carbon was 20 nm with a standard deviation of 5 nm. The morphology of samples was examined using scanning electron microscopy (SEM), which showed the flatness of the epoxy surface, and when the content of carbon increases, the connection between the epoxy array and carbon increases. The compression test indicates the effect of nano-size on enhancing the mechanical properties of the studied samples. To survey the shielding properties of the epoxy/carbon composites using gamma-rays emitted from Am-241, Ba-133, Cs-137, Co-60, and Eu-152 sources, which covered a wide range of energies from 0.059 up to 1.408 MeV, the gamma intensity was measured using the NaI (Tl) detector. The linear and mass attenuation coefficients were calculated by obtaining the area under each peak of the energy spectrum observed from Genie 2000 software in the presence and absence of the sample. The experimental results obtained were compared theoretically with XCOM software. The comparison examined the validity of experimental results where the relative division rate ranged between 0.02 and 2%. Also, the measurement of the relative division rate between linear attenuation coefficients of microand nano-composites was found to range from 0.9 to 21% The other shielding parameters are calculated at the same range of energy, such as a half-value layer (HVL), mean free path (MFP), tenth-value layer (TVL), effective atomic number (Zeff), and the buildup factors (EBF and EABF). The data revealed a consistent reduction in the particle size of the shielding material across various weight percentages, resulting in enhanced radiation shielding capabilities. The sample that contains 30% nano-carbon has the lowest values of TVL (29.4 cm) and HVL (8.85 cm); moreover, it has the highest value of the linear attenuation coefficient (LAC), which makes it the best in its ability to attenuate radiation.

Herein, the present work focuses on the effective counter electrode for dye-sensitized solar cells. The bottom–up approach was adapted to synthesize Mn2O3 nanorods via the hydrothermal method and the reduced graphene oxide was merged with Mn2O3 to prepare a nanocomposite. The prepared nanocomposites were subjected to physio-chemical and morphological characterizations which revealed the crystalline nature of Mn2O3 nanorods. The purity level rGO was characterized using the Raman spectrum and the Fourier transform infrared spectroscopy employed to find the functional groups. The morphological micrographs were visualized using SEM and TEM and the high aspect ratio Mn2O3 nanorods were observed with 5–7 nm and supported by rGO sheets. The electrocatalytic nature and corrosion properties of the counter electrode towards the iodide electrolyte were studied using a symmetrical cell. The as-synthesized nanocomposites were introduced as counter electrodes for DSSC and produced 4.11% of photoconversion efficiency with lower charge transfer resistance. The fabricated DSSC devices were undergone for stability tests for indoor and outdoor atmospheres, the DSSC stability showed 93% and 80% respectively for 150 days.

Carbon dots (CDs) are versatile nanomaterials with tunable luminescent properties. We used a natural plant kaempferol as a carbon source to synthesize multicolor CDs by reacting it with various nitrogen sources. Blue, green, and red CDs (B-CDs, G-CDs, and R-CDs) with emission wavelengths of 445 nm, 510 nm, and 600 nm respectively were successfully synthesized. Their photoluminescence quantum yields of are up to 37.4%, 20.1%, and 30.8%, respectively. Surface analysis revealed abundant nitrogen groups influencing luminescence. B-CDs and G-CDs show excitation-dependent emissions, indicating a potential correlation between their luminescence and particle sizes, while R-CDs exhibit excitation-independent emission, suggesting they belong to molecular state CDs. All three CDs exhibit stable luminescent performance, as well as good salt resistance and photobleaching resistance. The practical application of multicolored CDs in anti-counterfeiting fluorescent inks was further explored. This work offers a straightforward, eco-friendly route to synthesize multicolor CDs.

In this paper, iron ore tailings (IOT) were separated from the tailings field and used to prepare cement stabilized macadam (CSM) with porous basalt aggregate. First, the basic properties of the raw materials were studied. Porous basalt was replaced by IOT at ratios of 0, 20 %, 40 %, 60 %, 80 %, and 100 % as fine aggregate to prepare CSM, and the effects of different cement dosage (4 %, 5 %, 6 %) on CSM performance were also investigated. CSM’s durability and mechanical performance with ages of 7 d, 28 d, and 90 d were studied with the unconfined compression strength test, splitting tensile strength test, compressive modulus test and freeze-thaw test, respectively. The changes in Ca2+ content in CSM of different ages and different IOT ratios were analyzed by the ethylene diamine tetraacetic acid (EDTA) titration method, and the micro-morphology of CSM with different ages and different IOT replaced ratio were observed by scanning electron microscopy (SEM). It was found that with the same cement dosage, the strengths of the IOT-replaced CSM were weaker than that of the porous basalt aggregate at early stage, and the strength was highest at the replaced ratio of 60 %. With a cement dosage of 4 %, the unconfined compressive strength of CSM without IOT was increased by 6.78 % at ages from 28 d to 90 d, while the splitting tensile strength increased by 7.89 %. However, once the IOT replaced ratio reached 100 %, the values increased by about 76.24 % and 17.78 %, which was better than 0 % IOT. The CSM-IOT performed better than the porous basalt CSM at 90 d age. This means IOT can replace porous basalt fine aggregate as a pavement base.

In this study, four different samples of Se60Ge40-xBix chalcogenides glasses were synthesized by heating the melt for 18 h in vacuum Pyrex ampoules (under a 10-4 Torre vacuum), each with a different concentration (x = 0, 10, 15, and 20) of high purity starting materials. The results of direct current (DC) electrical conductivity measurements against a 1,000/T plot for all chalcogenide samples revealed two linear areas at medium and high temperatures, each with a different slope and with different activation energies (E1 and E2). In other words, these samples contain two electrical conduction mechanisms: a localized conduction at middle temperatures and extended conduction at high temperatures. The results showed the local and extended state parameters changed due to the effective partial substitution of germanium by bismuth. The density of extended states N(Eext) and localized states N(Eloc) as a function of bismuth concentration was used to gauge this effect. While the density of the localized states decreased from 1.6 × 1014 to 4.2 × 1012 (ev-1 cm-3) as the bismuth concentration increased from 0 to 15, the density of the extended states generally increased from 3.552 × 1021 to 5.86 × 1021 (ev-1 cm-3), indicating a reduction in the mullet’s randomness. This makes these alloys more widely useful in electronic applications due to the decrease in the cost of manufacturing.

This review explores the potential of pillared bentonite materials as solid acid catalysts for synthesizing diethyl ether, a promising renewable energy source. Diethyl ether offers numerous environmental benefits over fossil fuels, such as lower emissions of nitrogen oxides (NOx) and carbon oxides (COx) gases and enhanced fuel properties, like high volatility and low flash point. Generally, the synthesis of diethyl ether employs homogeneous acid catalysts, which pose environmental impacts and operational challenges. This review discusses bentonite, a naturally occurring alumina silicate, as a heterogeneous acid catalyst due to its significant cation exchange capacity, porosity, and ability to undergo modifications such as pillarization. Pillarization involves intercalating polyhydroxy cations into the bentonite structure, enhancing surface area, acidity, and thermal stability. Despite the potential advantages, challenges remain in optimizing the yield and selectivity of diethyl ether production using pillared bentonite. The review highlights the need for further research using various metal oxides in the pillarization process to enhance surface properties and acidity characteristics, thereby improving the catalytic performance of bentonite for the synthesis of diethyl ether. This development could lead to more efficient, environmentally friendly synthesis processes, aligning with sustainable energy goals.

Recently, domestic fishing production of Japanese horse mackerel has been continuously decreasing. To achieve sustainable fishing of this species, it is essential to acquire its target strength (TS) for accurate biomass estimation and to study its ecological characteristics. To date, there has been no TS research using a broadband echosounder targeting Japanese horse mackerel. In this study, for the first time, we synchronized an underwater camera with a broadband frequency (nominal center frequency of 200 kHz, range: 160-260 kHz) to measure the TS according to the body size (16.8-35.5 cm) and swimming angle of the species. The relationship between Japanese horse mackerel length and body weight showed a general tendency for body weight to increase as length increased. The pattern of the frequency spectra (average values) by body length exhibited a similar trend regardless of body length, with no significant fluctuations in frequency observed. The lowest TS value was observed at 243 kHz while the highest TS values were recorded at 180 and 257.5 kHz. The frequency spectra for the swimming angles appeared to be flat at angles of –5, 0, 30, 60, 75, and 80° while detecting more general trends of frequency spectra for swimming angle proved challenging. The results of this study can serve as fundamental data for Japanese horse mackerel biomass estimation and ecological research.