In the present work, the reaction pathways and the origin of catalytic activity for the production of lactic acid from glycerol catalyzed by an iridium−heterocyclic carbene (Iridium-NHC) complex at 383.15 K were investigated by DFT study at the M06-D3/6-311++G (d, p)//SDD level. Compared to the noncatalytic reaction pathway, the energy barrier sharply decreased from 75.2 kcal mol−1 to 16.8 kcal mol−1 with the introduction of the iridium−NHC complex. The catalytic reaction pathway catalyzed by the iridium−NHC complex with a coordinated hydroxide included two stages: the dehydrogenation of glycerol to 2,3-dihydroxypropanal, and the subsequent isomerization to lactic acid. Two reaction pathways, including dehydrogenation in terminal and that in C2-H, were studied. It was found that the formation of dihydroxyacetone from the H-removal in C2-H was more favorable, which might have been due to the lower energy of LUMO, whereas dihydroxyacetone could be easily transferred to 2,3-dihydroxypropa... [more]

The increased use of plastics has seen the emergence of microplastics, which have become progressively more problematic. Although many degradation studies have been conducted to address the problem of microplastics, their impact has not been significant, and much time has been consumed. In this study, low-density polyethylene (LDPE) was degraded using a dielectric barrier discharge (DBD) plasma under various electrical conditions. The experimental results showed that after 120 min of treatment, the removal efficiency reached 5.44%, the carbonyl index (CI) was 1.7308, and the O/C ratio was 0.028. The degree of degradation shown in previous studies was achieved rapidly, and experimental results showed that the degree of LDPE degradation and energy yield was proportional to the voltage and frequency—more specifically, the degree of LDPE surface and internal degradation differed, which should be considered in terms of reducing the extent of mass loss. The results of this study should be he... [more]

The problem of hydraulic parameters estimation lies in the depth: the deeper the rock formation, the more expensive and difficult the field tests and samples acquisition, and the more challenging the technical issues. The article assesses the Triassic sandstone’s drainage potential at the stage of shaft sinking. It focuses on parameter analysis in varied scales, from drill-core sample laboratory testing, through a single well drawing test, to long-term pumping and recovery tests in the well with observation piezometers. The obtained results are compared to the values estimated in the past using different methods. Finally, the paper states whether it is reliable to forecast pore-fissure sandstone drainage potential based only on core samples’ laboratory tests. This research proved that lab tests underestimate pore-fissure rocks’ hydraulic parameters (mean hydraulic conductivity k = 9.79 × 10−8 m/s) tenfold more than long-term pumping tests (mean k = 4.45 × 10−7 m/s). However, it can be... [more]

Previous studies have shown that shale oil mobility depends on the relative content of free oil and adsorbed oil. However, the research on how to establish a shale oil mobility evaluation is relatively insufficient. This study aims to use pyrolysis data before and after extraction to accurately identify the content of free oil and adsorbed oil, analyze the influencing factors of shale oil mobility, characterize the hydrocarbon generation and expulsion process, and evaluate shale oil mobility. We utilized an integrated mineralogical and geochemical dataset from the PS18-1 well in the Liutun Sag, Dongpu Depression, Bohai Bay Basin. The results show that the adsorption capacity of type I organic matter (OM) on shale oil is greater than that of type II OM, the OM abundance is of great significance to shale oil mobility, and that quartz and feldspar can promote shale oil mobility. The Tmax corresponding to the threshold of hydrocarbon expulsion is 438~440 °C, and the oil saturation index (O... [more]

Nitrogen adsorption experiments have been extensively applied to shale pore structure research and evaluation. The pore structure can be quantitatively characterized in accordance with the nitrogen adsorption−desorption isotherm using various calculation models, whereas the results obtained using different models can more effectively indicate the pore characteristics of shale remains unclear. Further, there has not been any unified process in the optimization of calculation models for pore size distribution (PSD). In this study, the Barret−Joyner−Halenda adsorption (BJH-AD) and BJH desorption (BJH-DE) models were used with Longmaxi Formation shale as an example. Subsequently, the density functional theory (DFT) calculations were conducted on different shale lithofacies samples. Next, the pore structure parameters and heterogeneity obtained using different models were compared, and the consistency parameters of different models were obtained in accordance with Cronbach’s alpha. The resu... [more]

For the second member of the Permian Lucaogou Formation in Malang Sag, Santanghu Basin, we used field emission scanning electron microscopy (SEM), cryogenic nitrogen gas adsorption, and the micro/nano CT method, combined with the fractal theory, to depict the dense reservoir space types of the reservoir and the microcosmic pore structure characteristics, perform the quantitative evaluation of aperture size, pore shape, and connectivity, and to analyze the mineral composition of the micropore structure of the reservoir. The results show that the area is dominated by sandy/argillaceous dolomite, and the reservoir space types mainly develop dissolved intergranular pores and intergranular pores, a few microfractures, and parallel plate and slit nanoscale pores. There is a positive correlation between pore volume and specific surface area, with micropore volume accounting for 14.95%, mesopore volume at 82.47%, and macropore volume at 2.58%. The mesoporous volume provides the main pore stora... [more]

One of the hugely focused areas of research for addressing the world’s energy and environmental challenges is electrochemical water oxidation. Morphological modulation of nanomaterials is essential for producing efficient electrocatalysts to achieve the required results. The purpose can be achieved by controlling synthesis parameters, and this is a key factor which greatly influences the oxygen evolution reaction (OER) performance during electrochemical water splitting. In this study, synthesis of cobalt molybdate (CoMoO4) through a simple and low-cost hydrothermal/solvothermal strategy with tunable morphology is demonstrated. Different morphologies, namely rods-like, buds-like, and sheets-like, referred to as R-CMO, B-CMO, and S-CMO, respectively, have been obtained by systematically varying the solvent media. Their catalytic activity towards OER was investigated in 1.0 M aqueous KOH medium. R-CMO nanoparticles synthesized in an aqueous medium demonstrated the lowest overpotential val... [more]

The microscopic anisotropy of shale has an important impact on its mechanical properties and crack behavior, so it is essential to understand the microscopic origin of anisotropic growth with a more effective laboratory work scheme. Uniaxial compression test and three-point bending test are considered to be efficient means to study the elastic properties and crack behavior of rocks. In this paper, uniaxial compression experiments and three-point bending experiments were conducted on shale outcrops in the Changqing area using field emission scanning electron microscopy (SEM) and in situ tensile testing, and the microscopic deformation and crack processes were quantitatively characterized by the digital image correlation (DIC) method. For the compression experiments, the observation of the first principal strain fields indicated that the microscopic anisotropy of shale was related to the bedding planes, and the microscopic deformations were mainly concentrated in the clay mineral accumul... [more]

Dried sphagnum moss was ground using a pin mill and a hammer mill under various operating conditions, i.e., changes in the rotor frequency and feed rate. The specific energy consumption of the size reduction was recorded. The ground powder was characterized by median particle size, width of size distribution (span), loose and tapped bulk densities, and the Hausner ratio. Pin milling used less energy for size reduction than hammer milling, especially when the target size was below 100 μm. In both milling methods, the specific energy consumption was mainly caused by the rotor frequency used. However, in pin milling, the specific energy consumption was also dependent on the production rate: the higher the rate, the higher the energy consumption. No such dependence was observed with the hammer mill. The span was wider in pin milling than hammer milling in the intermediate product size range although the difference decreased at the fine and coarse ends. A similar pattern was found for bulk... [more]

Fibrous materials are often used in the manufacturing of fire protection devices such as fire curtains. Their optimization and improved performance is still a topic of interest. The present work aims to develop and test a new combination of fibers arranged in various 2D and 3D patterns with coatings. For this purpose, basalt fibers were added into a glass fiber fabric, and wires of a shape memory material (SMM) were inserted into the fabric to create air pockets induced by temperature. In fire curtains, the base structure is a 2D basket pattern, and all combinations were tested with and without a waterborne polyurethane (WPU) coating with inorganic materials. Three different tests were selected to characterize the thermal behavior: fire resistance, ignitability, and smoke production. Fiberglass proved to be the best material to provide thermal resistance in fire curtains, with the outer surface temperature of the fabric below 650 °C at the end of the tests. The SMM wires provided good... [more]

In this paper, cement mortar IN200 integrated with solid−solid PlusIce X25 commercial PCM was fully characterized for the first time via experimental tests and numerical simulations. An experimental setup was designed and built to evaluate the thermal performance of the composite. Experimental results confirmed the expected advantages of the PCM-loaded plaster in terms of inner surface temperature, inbound heat flux reduction, and the enhanced damping effect on the average temperature. The experimental results were used to validate and calibrate a finite element model implemented in COMSOL Multiphysics® 5.6. The model was adopted to carry out a parametric analysis assessing the influence of PCM mass fraction, phase transition temperature, and PCM mortar thickness. The composite thickness was the most influential parameter, resulting in an energy saving increase from 3.29% to 72.72% as it was increased from 10 mm to 30 mm. Moreover, the model was used in a set of dynamic simulations, re... [more]

Inspired by pigeon feathers, the drag-reducing contribution of spanwise grooves was studied. Surface topography of the wing feather was scanned by an instrument of white light interference. Three types of grooves of triangle, rectangle, and trapezoid were adopted based on the unsymmetric microstructures found on the feather surface. Numerical simulations were conducted to analyze drag-reducing mechanisms. According to the simulation results, the rectangular groove reduced the wall shear stress more efficiently but with greater additional pressure drag, while the triangular groove was the opposite. For the trapezoidal groove similar to the feather structure, drag reduction was the best out of the three. Wind tunnel experiments for the trapezoidal groove were performed by using a cylindrical model and large-area plate. Drag reduction was confirmed from the cylindrical model at a series of velocities from 15 m/s to 90 m/s (about 16% at velocity of 30 m/s and about 8.5% at velocity of 60 m... [more]

Cementitious material based on synergistic industrial wastes can be used as a new product for low-carbon transformation. It can aid in resource recycling and suitable consumption and utilisation of various industrial wastes. The proposed material can reduce a large amount of CO2 emitted during calcination in cement production and the decomposition of raw limestone. In addition, the material exhibits high durability and high resistance to corrosion in the marine environment that can further reduce CO2 emissions over the lifecycle of the carbon footprint of the building. Currently, many similar chemical kinetic processes and mineralogical reaction processes of particle migration and rebinding exist in the hydration and hardening reactions, service processes and durability evolution of different industrial waste cementitious systems for low-carbon production. The theoretical basis of preparing various low-carbon cementitious materials (LCCMs) with industrial waste systems is discussed her... [more]

Analysis of fluid flow in naturally fractured reservoirs (NFRs), as a highly heterogeneous and complex system, requires a detailed study of the fracture-matrix interactions. The main process of fluid movement between the fracture and matrix is spontaneous imbibition (SI), which can occur in co/countercurrent fluid flow states. In addition, most carbonate rocks are fractured and non-water-wet, which can lead to low oil recovery. Wettability greatly affects the performance of the SI process. Injection of water or chemicals can be insufficient because fluids mostly pass through highly permeable fractures and lead to early breakthrough. Therefore, the wettability alteration mechanism should be applied in NFRs, and low-salinity water (LSW) injection is considered an effective enhanced oil recovery (EOR) approach. In this review, experimental and numerical studies of co/counter-imbibition are analyzed to show the importance of investigating the fracture-matrix interactions. In addition, the... [more]

Biomass gasification is one of the most promising routes to produce green hydrogen, power, fuels, and chemicals, which has drawn much attention as the world moves away from fossil fuels. Syngas produced from gasification needs to go through an essential gas cleanup step for the removal of tars and particulates for further processing, which is one of the cost-inducing steps. Existing hot gas cleanup strategies involve the particulate removal step followed by catalytic tar reforming, which could be integrated into a single unit operation using porous ceramics owing to their advantages including high-temperature resistance, high corrosion resistance, flexibility, and robust mechanical integrity. Ceramic filters have proven to be effective at filtering particulates from hot gas streams in various applications including combustion, incineration, gasification, and pyrolysis. These materials have also been evaluated and used to an extent as catalyst support to remove contaminants such as nitr... [more]

The electrochromic (EC) performance of smart windows is highly dependent on the rate of ions insertion/extraction. A direct way to increase the ion exchange in EC device is to modify the structure of the EC electrodes. Structural changes also affect the electrical conduction between the transparent electrodes and the EC layers, leading to efficient smart windows. In more detail, modifying the structure of the EC electrodes results in an increase in the surface-to-volume ratio, which is combined with the increase in charge transfer reaction between the insertion and extraction of ions. The current review summarizes the enhancement in the EC performance due to the fabrication of nano/microstructures or hybrid structures on the surface of the EC electrodes to increase their surface area. Moreover, metal oxide thin films have poor electrical conduction, which leads to a high charge transport barrier. Accordingly, improving the electrical conductivity of the EC layer is considered another e... [more]

The paper deals with an optimization of a magnetic circuit of the field exciter designed to control magnetorheological fluid (MRF) in a hybrid soft−rigid jaw gripper. The case discussed includes sealing of the MRF inside a cushion made of thermoplastic polyurethane (TPU). The shear stress distributions in the MRF upon magnetic field excitation have been analyzed for various permanent magnet, yoke, and air gap dimensions. In the developed numerical model of the magnetic field exciter, the geometry of the considered domain was parameterized. As part of the simulation study, more than 4600 variants of the magnetic circuit were analyzed, for which the shear stress distribution in the MRF inside the cushion was determined. The numerical model has been implemented in the Ansys Electronics Desktop 2020 finite element method (FEM) package. Research was focused on finding dimensions of the magnetic circuit that ensure the desired distribution of the shear stress in the MRF inside the cushion. T... [more]

The Brazilian Amazon is one of the main tropical wood-producing regions in the world, where exploration and industrial processing are among its main economic activities. Wood is characterized as a material consisting mainly of compounds with a high degree of polymerization and molecular weight such as cellulose, hemicellulose and lignin, in addition to other compounds such as ash and extractives. This chemical complexity of wood brings with it a wide possibility of chemical and thermochemical processing aiming at the production of bioproducts and biofuels. In this context, it is essential to know the physicochemical properties and thermal behavior of wood species from the Amazon biome to add value to the product, reducing waste and maximizing the species used. This work presents an investigation into the physicochemical and thermogravimetric characteristics of 21 species of wood from the Amazon, in addition to the determination of the higher heating value (HHV) of each one of them, foc... [more]

Walnut tree (Carya illinoensis (Wangenh.) K. Koch) is a plant species showing ecological, social, and economic importance in México. The objective was to determine biomass productivity and to characterize the raw material and biomass briquettes obtained from walnut thinning pruning. The variables evaluated were tree total height (TH), fresh biomass (FB) and dry biomass (DB) per hectare (kg ha−1). Briquettes were made by using the biomass obtained in both orchards. Laboratory tests for original biomass included moisture content (MC), ash content (AC), volatile matter (VM) and fixed carbon (FC), as well as high heating value (HHV). Briquette studies also included diameter (D), weight (W), length (L), volume (V), density (Ds), and HHV. The data were analyzed by using descriptive statistics and analysis of variance (ANOVA) under a completely randomized design with factorial arrangement. Thinning pruning in walnut orchards provides 12 kg tree−1 (998 kg ha−1) of dry biomass, with acceptable... [more]

This Special Issue titled “Heat Transfer Enhancement and Fluid Flow Features Due to the Addition of Nanoparticles in Engineering Applications” comprises nine original research articles devoted to recent advances, as well as up-to-date progress, in all areas of heat transfer due to the addition of different types of nanoparticles in engineering and its influence on emerging technologies [...]

The adverse effects of UV (ultraviolet) radiation on polymeric materials and organic constituents can damage the molecular structure of human skin and polymeric materials, resulting in their degradation. Therefore, additives or reagents for UV-shielding must be used in related applications, including polymer compounds and skin cosmetics. Bio-based polymers have shown great potential as alternatives to conventional metallic and organic materials (e.g., TiO2 and ZnO) in various applications; therefore, natural products have gained attention as a potential resource to overcome UV-induced health and environmental problems. In particular, biomass-derived materials such as lignin, fiber, and silica have been investigated as UV-shielding materials owing to their biocompatibility, biodegradability, and low carbon emissions. In this review, the UV-shielding effect and potential of various biomass-derived materials, such as silica, nanocellulose, and fibers, are reviewed. Among them, lignin is c... [more]

Solar photovoltaic (PV) technology has a lower adoption rate than expected because of different weather conditions (sunny, cloudy, windy, rainy, and stormy) and high material manufacturing costs. To overcome the barriers to adoption, many researchers are developing methods to increase its performance. A photovoltaic−thermal absorber hybrid system may shift its performance, but to become more efficient, the technology could improve with some strong thermal absorber materials. A phase change material (PCM) could be a suitable possibility to enhance the (electrical and thermal) PV performance. In this study, a solar PVT hybrid system is developed with a PCM and analyzed for comparative performance based on Malaysian weather conditions. The result shows PV performance (both electrical and thermal) was increased by utilizing PCMs. Electrical and thermal efficiency measurements for different collector configurations are compared, and PV performance and temperature readings are presented and... [more]

According to historical sources, a watermill existed in the valley of the Trojanka River on the north-western shore of Raduszyn Lake from the 15th century. Its dams lasted for centuries causing the water flow through the Raduszyn reservoir to slow down and deposit various mineral fractions in it. The aim of paper was to develop a scientific background for the sustainable management of organic matter extracted from the peat top and from deeper layers that are unsuitable for direct use, that is, decomposed peat. A SWOT (strengths, weaknesses, opportunities, threats) analysis was used to describe ways of restoration of the water reservoir alongside the characterization of organic matter and the financial condition of the studied enterprise. For the use of the studied material as a homogeneous substrate for plant cultivation, the contents of nitrogen, phosphorus, potassium, and copper were insufficient, whilst calcium was excessive. Microbiological analyses of the organic materials intende... [more]

The Upper Triassic Chang-7 Member of the Ordos Basin contains typical tight sandstone reservoirs. Reservoir quality is affected by diagenesis, which is a critical factor in tight oil exploration. In this study, the Chang-7 Member tight sandstones were studied by a variety of experimental methods, including thin sections, scanning electron microscopy (SEM), and X-ray diffraction (XRD), to determine the reservoir characteristics and diagenesis and discuss their influences on the reservoir quality. The Chang-7 Member sandstones are mainly lithic arkose and feldspathic litharenite with an average porosity and permeability of 7.17% and 0.13 mD, respectively. The pore type is mainly primary intergranular pores, and the secondary pores are feldspar dissolved pores, which are relatively developed, with pore radii of 2−20 µm. Diagenesis of Chang-7 Member tight reservoirs mainly includes compaction, quartz cementation, carbonate cementation, clay mineral cementation, and dissolution. The diagene... [more]

Thermogravimetric analysis (TGA) was utilised to compare the thermal stability of pure phase change material (D-mannitol) to that of nano-enhanced PCM (NEPCM) (i.e., PCM containing 0.5% and 1% multiwalled carbon nanotubes (MWCNT)). Using model-free kinetics techniques, the kinetics of pure PCM and NEPCM degradation were analysed. Three different kinetic models such as Kissinger-Akahira-Sunose (KAS), the Flynn-Wall-Ozawa (FWO), and the Starink were applied to assess the activation energies of the pure and nano-enhanced PCM samples. Activation energies for pure PCM using the Ozawa, KAS, and Starink methods ranged from 71.10−77.77, 79.36−66.87, and 66.53−72.52 kJ/mol, respectively. NEPCM’s (1% MWCNT) activation energies ranged from 76.59−59.11, 71.52−52.28, and 72.15−53.07 kJ/mol. Models of machine learning were utilised to predict the degradation of NEPCM samples; these included linear regression, support vector regression, random forests, gaussian process regression, and artificial neur... [more]