Recent progress on the discrete element method simulations for powder transport systems: A review

Powder transport systems are ubiquitous in various industries, where they can encounter single powder flow, two-phase flow with solids carried by gas or liquid, and gas–solid–liquid three-phase flow. System geometry, operating conditions, and particle properties have significant impacts on the flow behavior, making it difficult to achieve good transportation of granular materials. Compared to experimental trials and theoretical studies, the numerical approach provides unparalleled advantages over the investigation and prediction of detailed flow behavior, of which the discrete element method (DEM) can precisely capture complex particle-scale information and attract a plethora of research interests. This is the first study to review recent progress in the DEM and coupled DEM with computational fluid dynamics for extensive powder transport systems, including single-particle, gas–solid/solid–liquid, and gas–solid–liquid flows. Some important aspects (i.e., powder electrification during pneumatic conveying, pipe bend erosion, non-spherical particle transport) that have not been well summarized previously are given special attention, as is the application in some new-rising fields (ocean mining, hydraulic fracturing, and gas/oil production). Studies involving important large-scale computation methods, such as the coarse grained DEM, graphical processing unit-based technique, and periodic boundary condition, are also introduced to provide insight for industrial application. This review study conducts a comprehensive survey of the DEM studies in powder transport systems.     

An analytical model for gas leakage through contact interface in proton exchange membrane fuel cells

Sealing performance between two contacting surfaces is of significant importance to stable operation of proton exchange membrane (PEM) fuel cells. In this work, an analytical micro-scale approach is first established to predict the gas leakage in fuel cells. Gas pressure and uneven pressure distribution at the interface are also included in the model. At first, the micro tortuous leakage path at the interface is constructed by introducing contact modelling and fractal porous structure theory. In order to obtain the leakage at the entire surface, contact pressure distribution is predicted based on bonded elastic layer model. The gas leakage through the discontinuous interface can be obtained with consideration of convection and diffusion. Then, experiments are conducted to validate the numerical model, and good agreement is obtained between them. Finally, influences of surface topology, gasket compression and gasket width on leakage are studied based on the model. The results show that gas leakage would be greatly amplified when the asperity standard deviation of surface roughness exceeds 1.0 μm. Gaskets with larger width and smaller thickness are beneficial to sealing performance. The model is helpful to understand the gas leakage behavior at the interface and guide the gasket design of fuel cells.     

A review of thin film electrolytes fabricated by physical vapor deposition for solid oxide fuel cells

The ohmic resistance in solid oxide fuel cells (SOFCs) mainly comes from the electrolyte, which can be reduced by developing novel electrolyte materials with higher ionic conductivity and/or fabricating thin-film electrolytes. Among various kinds of thin-film fabrication technology, the physical vapor deposition (PVD) method can reduce the electrolyte thickness to a few micrometers and mitigate the issues associated with high-temperature sintering, which is necessary for wet ceramic methods. This review summarizes recent development progress in thin-film electrolytes fabricated by the PVD method, especially pulsed laser deposition (PLD) and magnetron sputtering. At first, the importance of the substrate surface morphology for the quality of the film is emphasized. After that, the fabrication of thin-film doped-zirconia and doped-ceria electrolytes is presented, then we provide a brief summary of the works on other types of electrolytes prepared by PVD. Finally, we have come to the summary and made perspectives.     

Electrosynthesis of eco-friendly electrocatalyst based nickel-copper bimetallic nanoparticles supported on poly-phenylenediamine with highest current density and early ethanol oxidation onset potential

Bimetallic catalysts have been investigated as the most efficient materials to accelerate the chemical transformations at the anode in Direct Ethanol Fuel Cells. A comparative study is presented here to synthesize Ni–Cu bimetallic nanoparticles for the ethanol oxidation reaction on three conducting polymers: poly-ortho-phenylenediamine, poly-meta-phenylenediamine, and poly-para-phenylenediamine. X-ray diffraction (XRD), Scanning Electron Microscopy (SEM), Transmission Electron Microscopy (TEM), and Electrochemical Impedance Spectroscopy (EIS) were used to analyze the modified electrodes. A series of bimetallic Ni–Cu nanoparticles with tunable ratios were successfully synthesized by simply changing the concentrations of Nickel and Copper. It has been confirmed that the best Ni/Cu molar ratio was 25% in the aspect of catalytic performance. The electrocatalyst exhibited an excellent catalytic activity with an anodic current of 70.5 mA cm^?2 at the lowest onset potential of 0.39 V with impressive stability. Ni₄Cu₁/PpPD should be considered as a good alternative to noble metal anode catalyst.     

The role of microbial electrogenesis in regulating methane and nitrous oxide emissions from constructed wetland-microbial fuel cell

This study assesses a sustainable solution to greenhouse gases (GHGs) mitigation using constructed wetland-microbial fuel cells (CW-MFC). Roots of wetland plant Acorus Calamus L. are placed in biological anode to better enable anode microorganisms to obtain rhizosphere secretion for power improvement. Three selected cathode materials have a large difference in GHG emissions, and among them, carbon fiber felt (CFF) shows the lowest emissions of methane and nitrous oxide, which are 0.77 ± 0.04 mg/(m²·h) and 130.78 ± 13.08 μg/(m²·h), respectively. The CFF CW-MFC achieves the maximum power density of 2.99 W/m³. As the influent pH value is adjusted from acidic to alkaline, the GHGs emissions are reduced. The addition of Ni inhibits GHGs emission but decreases the electricity, the power density is reduced to 1.09 W/m³, and the methane and nitrous oxide emission fluxes decline to 0.20 ± 0.04 mg/(m²·h) and 15.49 ± 1.86 μg/(m²·h), respectively. Low C/N ratio reduces methane emission, while high C/N ratio effectively inhibits nitrous oxide emission. At the influent pH 8 and C/N = 5:1, the methane emission flux is approximately 10.60 ± 0.27 mg/(m²·h), and the nitrous oxide emission flux is only 10.90 ± 1.10 μg/(m²·h). Based on the above experimental results by controlling variable factors, it is proposed that CW-MFC offers an environment-friendly solution to regulate GHG emissions.     

Sintering behavior of BaCe0.7Zr0.1Y0.2O3-δ electrolyte at 1150 °C with the utilization of CuO and Bi2O3 as sintering aids and its electrical performance

BaCe_0.7Zr_0.1Y_0.2O_3-δ (BCZY) is one of the promising electrolytic candidate for solid oxide fuel cell (SOFC) due to its good proton conductivity and better stability. Herein, the effect of dual sintering aids such as CuO-Bi₂O₃ upon the sinterability at low temperature, improved electrochemical properties, and thermo-chemical changes about proton-conducting BaCe_0.7Zr_0.1Y_0.2O_3-δ electrolyte were investigated in detail. FESEM micrographs and shrinkage curves revealed significant improvement in sinterability and densifications of BCZY electrolyte. The dense pellets were sintered with CuO-Bi₂O₃ (2–3 mol %) as sintering aids at a temperature of 1150 °C for 5 h. The perfectly uniform distribution of sintering aids increased the linear shrinkage of BCZY from 5% till 19–21%. The crystallite size and grain growth within the structure was enhanced due to the formation of the melting phase of Bi₂O₃ and Cu²⁺ incorporation in the perovskite structure. The elevated and improved electrochemical measurement for BCZY with 2 mol% of CuO-Bi₂O₃ as sintering aid categorized it well suited for solid oxide fuel cells.     

Investigation of La0.6Sr0.4Co1-xNixO3-δ (x=0, 0.2, 0.4, 0.6, 0.8) catalysts on solid oxide fuel cells anode for biogas dry reforming

The introduction of catalyst on anode of solid oxide fuel cell (SOFC) has been an effective way to alleviate the carbon deposition when utilizing biogas as the fuel. A series of La_0.6Sr_0.4Co_1-xNi_xO_3-δ (x = 0, 0.2, 0.4, 0.6, 0.8) oxides are synthesized by sol-gel method and used as catalysts precursors for biogas dry reforming. The phase structure of La_0.6Sr_0.4Co_1-xNi_xO_3-δ oxides before and after reduction are characterized by X-ray diffraction (XRD). The texture properties, carbon deposition, CH₄ and CO₂ conversion rate of La_0.6Sr_0.4Co_1-xNi_xO_3-δ catalysts are evaluated and compared. The peak power density of 739 mW cm^?2 is obtained by a commercial SOFC with La_0.6Sr_0.4Co_0.4Ni_0.6O_3-δ catalyst at 850 °C when using a mixture of CH₄: CO₂ = 2:1 as fuel. This shows a great improvement from the cell without catalyst for internal dry reforming, which is attributed to the formation of NiCo alloy active species after reduction in H₂ atmosphere. The results indicate the benefits of inhibiting the carbon deposition on Ni-based anode through introducing the La_0.6Sr_0.4Co_0.4Ni_0.6O_3-δ catalyst precursor. Additionally, the dry reforming technology will also help to convert part of the exhaust heat into chemical energy and improve the efficiency of SOFC system with biogas fuel.     

A novel combustion fuel for the synthesis of nanocrystalline ZnAl2O4 particles based on the thermodynamic correlations and their structural and optical studies

ZnAl₂O₄ nanocrystalline particles were prepared using the solution combustion method using a new combustion fuel, Leucine. The prepared samples' structural, microstructural–elemental composition, and optical characteristics were investigated using XRD, SEM-EDS, and UV–Visible spectroscopy. As-synthesized ZnAl₂O₄ nanoparticles are polycrystalline, with no secondary phases, and crystallized in a cubic - spinel structure. The polycrystalline nature of the prepared sample is due to the exothermicity of fuel and oxidizer, which demonstrate that the fuel utilized (Leucine) provided adequate energy for the production of nanoparticles in their as-synthesized form, as supported by adiabatic temperature through thermodynamic calculations. The thermodynamic calculations also include a universal method to estimate the specific heat capacity at constant pressure. Furthermore, even after 2 h of calcination at 600 °C, ZnAl₂O₄ exhibits a single phase with no secondary phases, indicating the material stability and single-phase nature. The crystallinity of ZnAl₂O₄ nanoparticles was observed to increase with increasing annealing temperature. SEM micrographs of as-synthesized samples exhibit the formation of dense particles, voids, and pores in the as-synthesized sample. In addition, tiny aggregates were detected on the surface of more prominent clusters, which reduced as the calcination progressed. In addition, calcined samples exhibit a greater optical reflectance than as-synthesized samples. Tauc's graphs were used to compute the optical energy bandgap. The calculated energy band gap is redshifted to that of the bulk material. The bandgap energy decreases upon calcination, suggesting that the prepared materials have a larger crystallite size or more crystallinity. Correlations were found between the T_ad, and the structural and optical properties of the prepared samples. The findings suggest that Leucine could be used as a novel combustion fuel to produce crystalline ZnAl₂O₄ nanoparticles in their as-synthesis form.     

Dynamic simulation and lifecycle assessment of hydrogen fuel cell electric vehicles considering various hydrogen production methods

In this research study, a real model of a hydrogen fuel cell vehicle is simulated using Simcenter Amesim software. The software used for vehicle simulation enabled dynamic simulation, resulting in more precise simulation. Furthermore, considering that fuel cell degradation is one of the significant challenges confronting fuel cell vehicle manufacturers, we examined the impact of fuel cell degradation on the performance of hydrogen vehicles. According to the findings, a hydrogen vehicle with a degraded fuel cell consumes 14.3% more fuel than a fresh fuel cell hydrogen vehicle. A comprehensive life cycle assessment (LCA) is also performed for the designed hydrogen vehicle. The results of the hydrogen vehicle life cycle assessment are compared with a gasoline vehicle to fully understand the effect of hydrogen vehicles in reducing air emissions. The methods considered for hydrogen production included natural gas reforming, electrolysis, and thermochemical water splitting method. Furthermore, because the source of electricity used for electrolysis has a significant impact on the life cycle emission of a hydrogen vehicle, three different power sources were considered in this assessment. Finally, while a hydrogen vehicle with a degraded fuel cell emits lower carbon dioxide (CO₂) than a gasoline vehicle, the emitted CO₂ from this vehicle using hydrogen from electrolysis is approximately 25% higher than that of a new hydrogen vehicle.     

Manufacturing catalyst-coated membranes by ultrasonic spray deposition for PEMFC: Identification of key parameters and their impact on PEMFC performance

This study deals with the manufacturing of catalyst-coated membranes (CCMs) for newcomers in the field of coating. Although there are many studies on electrode ink composition for improving the performance of proton-exchange membrane fuel cells (PEMFCs), there are few papers dealing with electrode coating itself. Usually, it is a know-how that often remains secret and constitutes the added value of scientific teams or the business of industrialists. In this paper, we identify and clarify the role of key parameters to improve coating quality and also to correlate coating quality with fuel cell performance via polarization curves and electrochemical active surface area measurements. We found that the coating configurations can affect the performance of lab-made CCMs in PEMFCs. After the repeatability of the performance obtained by our coating method has been proved, we show that: (i) edge effects, due to mask shadowing - cannot be neglected when the active surface area is low, (ii) a heterogeneous thickness electrode produces performance lower than a homogeneous thickness electrode, and (iii) the origin and storage of platinum on carbon powders are a very important source of variability in the obtained results.