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13. LAPSE:2024.0255
Improving the Energy Efficiency of the Production of Pipes Welded with High-Frequency Induction
February 19, 2024 (v1)
Subject: Energy Systems
Keywords: electric power, heat-affected zone, high-frequency induction, inductor, squeeze
This article presents the technical aspects that may reduce electric power consumption during the welding of pipes with the high-frequency induction (HFI) method. Experiments were carried out at Huta Łabędy S.A. Steelworks, during the test production of 323.9 × 5.6 mm pipes of P235GH steel grade. Two sets of HFI heating system settings were studied: with a variable squeeze force of the heated edges and a variable position of the inductor in relation to the welding point. It was proven that the temperature at the welding point increased due to the stronger squeeze of the heated edges, which reduced the electric power consumption. Reducing the distance of the inductor relative to the welding point had the same effect. By optimizing the squeeze force and the position of the inductor, energy consumption was reduced by about 5.5%. Microstructural studies of the welds did not show any adverse effects of the optimization.
14. LAPSE:2024.0254
Systematic Evaluation of Research Progress in the Textile Field over the Past 10 Years: Bibliometric Study on Smart Textiles and Clothing
February 19, 2024 (v1)
Subject: Materials
Keywords: bibliometrics, CiteSpace, intellectual structure, knowledge mapping, smart fibers, smart textiles and clothing
Intelligent textile clothing is one of the most popular topics in the field. In recent decades, rapid advances have been made in the area of intelligent textile clothing research, and the intellectual structure pertaining to this domain has significantly evolved. We used CiteSpace 6.2.R4, VOSviewer 1.6.19, to evaluate and visualize the results, analyzing articles, countries, regions, institutions, authors, journals, citations, and keywords. Both a macroscopic sketch and a microscopic characterization of the entire knowledge domain were realized. The aim of this paper is to utilize bibliometric and knowledge mapping theories to identify relevant research papers on the subject of smart textiles and clothing that have been published by the China Knowledge Network Web of Science (WOS) within the last decade. It is concluded that the main topics of smart textile and garment research can be divided into nine categories: wearable electronics, smart textiles, flexible antennas, energy storage,... [more]
15. LAPSE:2024.0253
Advances in Triboelectric Nanogenerators for Sustainable and Renewable Energy: Working Mechanism, Tribo-Surface Structure, Energy Storage-Collection System, and Applications
February 19, 2024 (v1)
Subject: Energy Systems
Keywords: energy applications, energy collecting system, Energy Storage, renewable and sustainable, triboelectric nanogenerator
Triboelectric nanogenerators (TENGs) are emerging as a form of sustainable and renewable technology for harvesting wasted mechanical energy in nature, such as motion, waves, wind, and vibrations. TENG devices generate electricity through the cyclic working principle of contact and separation of tribo-material couples. This technology is used in outstanding applications in energy generation, human care, medicinal, biomedical, and industrial applications. TENG devices can be applied in many practical applications, such as portable power, self-powered sensors, electronics, and electric consumption devices. With TENG energy technologies, significant energy issues can be reduced or even solved in the near future, such as reducing gas emissions, increasing environmental protection, and improving human health. The performance of TENGs can be enhanced by utilizing materials with a significant contrast in their triboelectrical characteristics or by implementing advanced structural designs. This... [more]
16. LAPSE:2024.0252
Performance Improvement Overview of the Supercritical Carbon Dioxide Brayton Cycle
February 19, 2024 (v1)
Subject: Process Design
Keywords: binary mixture, combined cycle, performance improvement, review, supercritical carbon dioxide cycle
Efficiency and compactness are core strengths of the supercritical carbon dioxide (sCO2) Brayton cycle, which is considered an alternative to the steam Rankine cycle for moderate-temperature heat sources (350−800 °C). Numerical investigations on system design and analysis have received considerable attention, with the aim of improving the sCO2 cycle from the viewpoint of thermodynamics. This paper reviews and compares previous studies in the literature to survey different cycle layouts, operating parameters, and working fluids of the sCO2 cycle. Performance enhancement approaches are categorized into three classes according to characteristics: conventional methods, CO2 mixtures, and combined cycles. The strengths, weaknesses, and limitations of each categorized method are discussed. This research is expected to provide a roadmap for performance improvement that meets the interests of researchers.
17. LAPSE:2024.0251
A Full-State Reliability Analysis Method for Remanufactured Machine Tools Based on Meta Action and a Markov Chain Using an Exercise Machine (EM) as an Example
February 19, 2024 (v1)
Subject: Process Monitoring
Keywords: EM, full state, MA unit (MAU), Markov chain, reliability analysis, RMT
The reliability of an RMT can be regarded as an important indicator customers can use to recognize its quality; however, it is difficult to implement a full-state reliability analysis of an RMT due to its complicated structural functions. Therefore, a full-state reliability analysis model is proposed herein based on meta action (MA) and a Markov chain for remanufactured exercise machine tools (REMTs). First, an analysis was carried out on individual levels by integrating the MAU decomposition method, and an MAU fault tree model was established layer by layer for the REMT. Second, full-state modeling was performed in view of the MAU characteristics of the REMT, whose operation processes are divided into MAU normal and failure states. A Markov decision-making process was introduced to integrate MAU states and establish our model, which was solved by means of an analytical method for the evaluation of reliability. Finally, an example of a remanufactured machine tool spindle is given to ve... [more]
18. LAPSE:2024.0250
New Alternatives in the Fight against Tuberculosis: Possible Targets for Resistant Mycobacteria
February 19, 2024 (v1)
Subject: Biosystems
Keywords: diarylquinolines, drug resistant TB strains, Mycobacterium tuberculosis, natural products, novel vaccine generation, repurposing drugs, treatment
Tuberculosis (TB) is a bacterial disease that remains a global health threat due to the millions of deaths attributed to it each year. The emergence of drug resistance has exacerbated and further increased the challenges in the fight against this illness. Despite the preventive measures using the application of the Bacillus Calmette-Guérin vaccine, the desired immunization outcome is not as high as expected. Conventional TB treatments exhibit serious limitations, such as adverse effects and prolonged duration, leading to a pressing need for alternative and more effective treatment options. Despite significant efforts, it took nearly four decades for diarylquinoline to become the most recently approved medicine for this disease. In addition, various possibilities, such as the usage of medications used for many other conditions (repurposed drugs), have been explored in order to speed up the process of achieving faster outcomes. Natural compounds derived from various sources (microorganis... [more]
19. LAPSE:2024.0249
Antimicrobial Resistance of Heterotrophic Bacteria and Enterobacteriaceae Inhabiting an Anthropogenic-Affected River Stretch in Bulgaria
February 19, 2024 (v1)
Subject: Biosystems
Keywords: antibiotics, antimicrobial resistance, E. coli, Enterobacteriaceae, heterotrophic bacteria, surface water, waste water
The increasing antimicrobial resistance (AMR) of pathogens is a significant threat to human and animal health, but it is also an environmental challenge for water resources. The present study aimed to quantify heterotrophic bacteria resistant to five groups of antibiotics (ABs) in a selected Yantra River stretch (including its tributary, the Belitsa River); to assess AMR prevalence among Enterobacteriaceae; and to assess the impact of urban effluents or rural runoff on AMR prevalence along the river course at eight sampling points. Culture-dependent methods were used in a population-based study of total AMR and for AB susceptibility testing of Enterobacteriaceae isolates. The data reveal significant differences in AMR dissemination and a lower (up to 10%) proportion of different types of antibiotic-resistant bacteria (ARB) in the Yantra River water compared to the Belitsa River (up to 20%). The incidence of resistant Enterobacteriaceae isolates was in the range of 1% to gentamicin to 3... [more]
20. LAPSE:2024.0248
Reservoir Space Characterization of Ordovician Wulalike Formation in Northwestern Ordos Basin, China
February 19, 2024 (v1)
Subject: Materials
Keywords: foreland basin, fracture, Ordos Basin, Ordovician, reservoir characterization, reservoir space, siliceous shale, Wulalike Formation
The Ordovician Wulalike Formation in the northwestern Ordos Basin is a new prospect for exploring marine shale gas in China, facing prominent problems such as unclear reservoir conditions and the distribution of enrichment areas. The types of reservoir space, fracture development, porosity composition, and physical properties of the lower Wulalike Formation are discussed through the multi-method identification and quantitative evaluation of reservoir space for appraisal wells. The Wulalike Formation in the study area contained fractured shale reservoirs with matrix pores (mainly inorganic pores) and permeable fractures. The fracture system of the lower Wulalike Formation is dominated by open bed-parallel fractures that are intermittent or continuous individually, with a width of 0.1−0.2 mm and spacing of 0.5−14.0 cm. The fracture-developed intervals generally exhibit bimodal or multimodal features on NMR T2 spectra and have a dual-track feature with a positive amplitude difference in d... [more]
21. LAPSE:2024.0247
Computational Fluid Dynamics Simulation of Combustion and Selective Non-Catalytic Reduction in a 750 t/d Waste Incinerator
February 10, 2024 (v1)
Subject: Modelling and Simulations
Keywords: gas-solid two-phase combustion coupling, grate furnace, numerical simulation, SNCR
In this study, a Computational Fluid Dynamics (CFD) approach using Ansys Fluent 15.0 and FLIC software was employed to simulate the combustion process of a 750 t/d grate-type waste incinerator. The objective was to assess the performance of Selective Non-Catalytic Reduction (SNCR) technology in reducing nitrogen oxide (NOx) emissions. Two-stage simulations were conducted, predicting waste combustion on the bed and volatile matter combustion in the furnace. The results effectively depicted the temperature and gas concentration distributions on the bed surface, along with the temperature, velocity, and composition distributions in the furnace. Comparison with field data validated the numerical model. The findings serve as a reference for optimizing large-scale incinerator operation and parameter design through CFD simulation.
22. LAPSE:2024.0246
Study on Performance Optimization of Water-Rich Grouting Materials Based on Response Surface Methodology
February 10, 2024 (v1)
Subject: Materials
Keywords: gas extraction, orthogonal experiment methodology, response surface methodology, scanning electron microscope, water-rich grouting materials
The quality of borehole sealing is a key factor affecting the efficiency of gas production. A new water-rich grouting material (RW) with composite coagulant and other additives was prepared in this study to overcome the disadvantages of long setting time and low stone rate of traditional cement materials. When the coagulants A is 4 g and coagulants B is 2 g, the setting time of RW material was reduced by 60.85% and 50.62%, which significantly shortened the setting time of the RW material, respectively. Based on the orthogonal method, 29 groups of comparative experiments were designed to investigate the interaction mechanism between different additives on the performance index of RW, including setting time, water secretion rate, and compressive strength. Quadratic regression equations were fitted using the response surface method. All the correlation coefficients R2 of each response model were greater than 0.97, R2 and R2adj were less than 0.2 through variance analysis, indicating a hig... [more]
23. LAPSE:2024.0245
Research Regarding the Dimensional Precision of Electrical Steel Strips Machined by Waterjet Cutting in Multilayer Packages
February 10, 2024 (v1)
Subject: Modelling and Simulations
Keywords: dimensional accuracy, electrical motor, electrical steel strip, multilayer package, waterjet machining
Manufacturing parts made of thin steel in small batches is a challenging task in terms of reaching the proper balance between the productivity, the cost, and the dimensional precision. This paper presents the results of experimental research about manufacturing electrical steel thin parts using abrasive waterjet cutting. For a certain increase of productivity and a more efficient process, the parts were cut using multilayer packages of steel strips. The main objective was to analyze the influence of the number of layers on the dimensional precision of parts. Preliminary tests were performed, followed by a full factorial experiment using two independent parameters, the number of layers and the traverse speed. The parts were measured on a noncontact vision measurement machine and mathematical models were determined to predict the parts deviations depending on the independent parameters used. A practical validation of the models was performed. The main conclusion is that the number of lay... [more]
24. LAPSE:2024.0244
Low-Carbon Economic Dispatch of Electricity and Cooling Energy System
February 10, 2024 (v1)
Subject: Optimization
Keywords: building thermal inertia, carbon trading mechanism, elastic thermal comfort, electric-cooling dispatch, pipeline thermal characteristics
In response to the issue of the hydropower consumption of run-of-river hydropower stations in Southwest China, the district cooling system can provide regulation capacity for hydropower utilization and suppress fluctuations caused by the uncertainty of hydropower. The innovative method is to utilize the thermal characteristics of pipelines and buildings, as well as the thermal comfort elasticity to shift the cooling and electricity loads, which helps to consume the surplus hydroelectric power generation. Taking the minimum total cost of coal consumption in thermal power units, hydropower abandonment penalty, and the carbon trading cost as the objective function, models were established for power supply balance constraints, heat transport constraints, and unit output constraints. The hybrid integer linear programming algorithm was used to achieve the low-carbon economic dispatch of the electric-cooling system. The calculation examples indicate that compared to the traditional real-time... [more]
25. LAPSE:2024.0243
Integral Effects of Porosity, Permeability, and Wettability on Oil−Water Displacement in Low-Permeability Sandstone Reservoirs—Insights from X-ray CT-Monitored Core Flooding Experiments
February 10, 2024 (v1)
Subject: Materials
Keywords: low-permeability reservoir, permeability, porosity, waterflooding, wettability, X-ray CT
Porosity, permeability, and wettability are crucial factors that affect the oil−water displacement process in reservoirs. Under subsurface conditions, the integral effects of these factors are extremely difficult to document. In this paper, waterflooding experiments were carried out using a core flooding system monitored with X-ray dual-energy CT. The mesoscale, three-dimensional characteristics of water displacing oil were obtained in real time. The integral effects of porosity, permeability, and wettability on the waterflooding in the low-permeability sandstone reservoirs were investigated. It was found that if the reservoir rock is water-wet, then the residual oil saturation decreases gradually with increasing porosity and permeability, showing an increasing waterflooding efficiency. On the contrary, if the reservoir rock is oil-wet, the residual oil saturation gradually increases with improving porosity and permeability, showing a decreasing waterflooding efficiency. The porosity,... [more]
26. LAPSE:2024.0242
Improved Time-Varying BLF-Based Tracking Control of a Position-Constrained Robot
February 10, 2024 (v1)
Subject: Process Control
Keywords: adaptive control, barrier Lyapunov function, constraint control, robot, tracking control
In this work, one improved symmetric time-variant logarithmic barrier, Lyapunov function (BLF), is developed for the first time to handle the state constraint problem of nonlinear systems. It is universal in the sense that the improved barrier function is a general one that can be used not only in systems with constrained requirements but also in systems without constrained requirements, without altering the designed controller. First of all, the n-link robotic system is transformed into a kind of multi-input and multi-output (MIMO) system. Then, a trajectory tracking control scheme is designed by combining the improved time-variant logarithmic BLF with the disturbance observer to solve the problems of model uncertainty and position constraint for the robotic system. We give that under the proposed controller, all the robotic system’s error vectors can trend to the equilibrium point asymptotically while the constraint conditions on the position are always met. Finally, the effectivenes... [more]
27. LAPSE:2024.0241
Discrete Meta-Simulation of Silage Based on RSM and GA-BP-GA Optimization Parameter Calibration
February 10, 2024 (v1)
Subject: Numerical Methods and Statistics
Keywords: BP neural network, discrete element method, Genetic Algorithm, parameter calibration, response surface method, silage
The EDEM software (Altair EDEM 2022.0 professional version 8.0.0) was used to create a discrete element model of silage to address the lack of silage evidence parameters and contact parameters between silage and conveying equipment when using the discrete element method to simulate and analyze crucial aspects of silage conveying and feeding. Physical tests and simulations were used to calibrate the significant parameters, and the silage stacking angle obtained from simulation and tests was then validated. The response value of the stacking angle (38.65°) obtained from the physical examination was used as the response value. The response surface (RSM) finding and the GA finding based on the genetic algorithm (GA) artificial neural network (BP) model were used to compare the significance parameters. The PB and steepest climb tests were used to screen the significant factors. Results indicate that the static friction coefficient between silage and silage, the rolling friction coefficient... [more]
28. LAPSE:2024.0240
Stick−Slip Characteristics of Drill Strings and the Related Drilling Parameters Optimization
February 10, 2024 (v1)
Subject: Optimization
Keywords: drill string, drilling parameter, Optimization, stick–slip vibration
To eliminate or reduce stick−slip vibration in torsional vibration of the drilling string and improve the rate of penetration (ROP), a stick−slip vibration model of the drilling string considering the ROP was established based on the multidimensional torsional vibration model of the drilling string. The model was verified by simulation analysis. The characteristics of the drilling string stick−slip vibration in the three stages of stationary, slip, and stick were analyzed. This paper investigated the influence of rotary torque, rotary speed, and weight on bit (WOB) on stick−slip vibrations in the drill string. Based on this, the relationship between the drilling parameters and ROP was established. Drilling parameter optimization was completed for soft, medium-hard, and hard formations. Results showed that appropriately increasing torque and decreasing WOB can reduce or even eliminate stick−slip vibrations in the drill string and increase the ROP. The parameter optimization increased th... [more]
29. LAPSE:2024.0239
Anomaly Recognition, Diagnosis and Prediction of Massive Data Flow Based on Time-GAN and DBSCAN for Power Dispatching Automation System
February 10, 2024 (v1)
Subject: Process Control
Keywords: DBSCAN, fault diagnosis, fault prediction, supervised learning, Time-GAN
Existing power anomaly detection is mainly based on analyzing static offline data. But this method takes a long time and has low identification accuracy when detecting timing and frequency anomalies, since this method requires offline screening, classification and preprocessing of the collected data, which is very laborious. Anomaly detection with supervised learning requires a large amount of abnormal data and cannot detect unknown anomalies. So, this paper innovatively proposes the idea of applying Time-series Generative Adversarial Networks (Time-GAN) in a dispatching automation system for the identification, diagnosis and prediction of massive data flow anomalies. First of all, regarding the problem of insufficient abnormal data, we use Time-GAN to generate a large number of reliable datasets for training fault diagnosis models. In addition, Time-GAN can ameliorate the imbalance between various types of data. Secondly, unsupervised learning methods such as Density-Based Spatial Clu... [more]
30. LAPSE:2024.0238
Response of Nitrogen Removal Performance and Microbial Distribution to Seasonal Shock Nutrients Load in a Lakeshore Multicell Constructed Wetland
February 10, 2024 (v1)
Subject: Biosystems
Keywords: hydraulic characters, lakeshore wetlands, microbial community, nitrogen removal, nonpoint source pollution, spatial and temporal regulation
Multicell constructed wetlands (MCWs) on lakeshores are a prospective treatment technique. However, the factors affecting the nutrient removal performance of lakeshore MCWs at the field scale are unclear. This study chose a field-scale lakeshore MCW with the highest mass removal efficiency (approximately 49,175.12 mg m−2 day−1) for total nitrogen removal in the wet season to investigate the response of nitrogen removal and microbial distribution to seasonal shock nutrients load. The mass loading rates in the wet season were as high as 43~72 times over those in the dry season. Hence, a storage pond (SP), as a forebay retention cell, was necessary to mitigate the shock loads of the influent, which is beneficial to nitrogen removal of the MCW system. The two major genera in the sediments are heterotrophic nitrification−aerobic denitrification bacteria, and the abundance and species of the nitrogen-related functional genera were higher in the wet season than the dry season. According to th... [more]
31. LAPSE:2024.0237
A Lightweight Identification Method for Complex Power Industry Tasks Based on Knowledge Distillation and Network Pruning
February 10, 2024 (v1)
Subject: Intelligent Systems
Keywords: knowledge distillation, network pruning, power industry, service identification
Lightweight service identification models are very important for resource-constrained distribution grid systems. To address the increasingly larger deep learning models, we provide a method for the lightweight identification of complex power services based on knowledge distillation and network pruning. Specifically, a pruning method based on Taylor expansion is first used to rank the importance of the parameters of the small-scale network and delete some of the parameters, compressing the model parameters and reducing the amount of operation and complexity. Then, knowledge distillation is used to migrate the knowledge from the large-scale network ResNet50 to the small-scale network so that the small-scale network can fit the soft-label information output from the large-scale neural network through the loss function to complete the knowledge migration of the large-scale neural network. Experimental results show that this method can compress the model size of the small network and improv... [more]
32. LAPSE:2024.0236
Study on Process Parameters in Hydrothermal Liquefaction of Rice Straw and Cow Dung: Product Distribution and Application of Biochar in Wastewater Treatment
February 10, 2024 (v1)
Subject: Process Design
Keywords: bio-char, bio-oil, colorants, cow dung, hydrothermal liquefaction, rice straw
In this study, rice straw (RS) and cow dung (CD) waste were hydrothermally processed for the recovery of bio-oil and biochar. The hydrothermal experiments were performed in a 5 L capacity reactor under the following process conditions: temperature (240−340 °C), solvent to biomass ratios of 1:1, 1:2, 2:1, 1:3 and 3:1, a time of 1 h and a pressure of 15 bar. The HTL products were characterized via FTIR, SEM and GC−MS (gas chromatography mass spectrometry). It was seen that the maximum bio-oil yield was 32.5 wt% and the biochar yield was 18.5 wt% for the 2:1 RS:CD mixture at a temperature of 320 °C. The bio-oil contained hexadecane, heptadecane, octadecane and other hydrocarbons, and their presence was confirmed by GC−MS. The biochar was analyzed, and it was used in wastewater treatment to remove the colorants. The biochar also showed some promising results in the colorants removal study, with an efficiency of more than 76%.
33. LAPSE:2024.0235
Non-Classical Circularly Polarized Luminescence Control of Peptide Luminophore Based on Precise Chiral Space Control
February 10, 2024 (v1)
Subject: Biosystems
Keywords: chiral molecule, circularly polarized luminescence (CPL), peptide, pyrene
Light that rotates in a circular spiral when viewed from the front is known as circularly polarized luminescence (CPL), and can be divided into two types, namely, left- and right-rotating light. To emit both left- and right-rotating CPLs, two types of optically active luminophores, namely, enantiomer D- and L-bodies, are generally required. This mini-review mainly discusses our latest study on CPL properties via the control of the pyrene ring as the luminescent unit incorporated into chiral peptides. In this study, optically active peptide−pyrene organoluminescent materials that emit CPL were synthesized by combining a peptide as a frame and two pyrene rings as a luminescent unit. By adjusting the interpyrene distance, external conditions, and absolute chiral configuration (D- or L-configuration), the chiral spatial configuration of the luminescent pyrene ring was precisely controlled. Consequently, the direction of CPL rotation from pyrenylalanine-containing peptides with the same con... [more]
34. LAPSE:2024.0234
Mathematical Modeling of Prediction of Horizontal Wells with Gravel Pack Combined with ICD in Bottom-Water Reservoirs
February 10, 2024 (v1)
Subject: Modelling and Simulations
Keywords: bottom-water reservoir, gravel pack, horizontal wells, inflow control device
During the development of horizontal wells in bottom-water reservoirs, the strong heterogeneity of reservoir permeability leads to premature bottom-water breakthroughs at locations with high permeability in the horizontal wellbore, and the water content rises rapidly, which seriously affects production. To cope with this problem, a new technology has emerged in recent years that utilizes gravel filling to block the flow in the annulus between the horizontal well and the borehole and utilizes the Inflow Control Device (ICD) completion tool to carry out segmental water control in horizontal wells. Unlike conventional horizontal well ICD completions that use packers for segmentation, gravel packs combined with ICD completions break the original segmentation routine and increase the complexity of the production dynamic simulation. In this paper, the flow in different spatial dimensions, such as reservoirs, gravel-packed layers, ICD completion sections, and horizontal wellbores, is modeled... [more]
35. LAPSE:2024.0233
Atomic Orbital Search Algorithm for Efficient Maximum Power Point Tracking in Partially Shaded Solar PV Systems
February 10, 2024 (v1)
Subject: Energy Systems
Keywords: atomic orbital search (AOS), maximum power point tracking (MPPT), metaheuristic algorithms, partial shading condition (PSC), photovoltaic (PV)
The efficient extraction of solar PV power is crucial to maximize utilization, even in rapidly changing environmental conditions. The increasing energy demands highlight the importance of solar photovoltaic (PV) systems for cost-effective energy production. However, traditional PV systems with bypass diodes at their output terminals often produce multiple power peaks, leading to significant power losses if the optimal combination of voltage and current is not achieved. To address this issue, algorithms capable of finding the highest value of a function are employed. Since the PV power output is a complex function with multiple local maximum power points (LMPPs), conventional algorithms struggle to handle partial shading conditions (PSC). As a result, nature-inspired algorithms, also known as metaheuristic algorithms, are used to maximize the power output of solar PV arrays. In this study, we introduced a novel metaheuristic algorithm called atomic orbital search for maximum power point... [more]
36. LAPSE:2024.0232
Adsorption of Multi-Collector on Long-Flame Coal Surface via Density Functional Theory Calculation and Molecular Dynamics Simulation
February 10, 2024 (v1)
Subject: Modelling and Simulations
Keywords: Adsorption, collector, long-flame coal, molecular dynamics, quantum chemistry
The quantum chemical properties of long-flame coal (LFC) and collectors (kerosene, diesel, diethyl phthalate (DEP), biodiesel collector (BDC), and emulsified biodiesel collector (EBDC)) were analyzed via the density functional theory (DFT). The molecular dynamics (MD) of the coal−collector−water system and the adsorption of collectors on LFC were conducted based on the first principles. The results showed that the frontier molecular orbitals of kerosene, diesel, DEP, and BDC were 0.38 eV, 0.28 eV, 0.27 eV, and 0.20 eV, respectively. The chemical reactivity order of the above mentioned collectors was BDC > DEP > diesel > kerosene. Kerosene, diesel, and DEP adsorbed with carbonyl, hydroxyl, and carboxyl groups in LFC, respectively. Carboxyl groups in BDC and carboxyl groups in LFC bilaterally adsorbed, while BDC repelled water molecules via hydrogen bonds on the LFC surface. In the systems of BDC and EBDC, the diffusion coefficients of a water molecule were 2.83 × 10−4 cm2/s and 3.73 × 1... [more]
37. LAPSE:2024.0231
Biochemical Characterization and Fuel Properties of Endemic Taurus Flowering Ash (Fraxinus ornus subsp. cilicica) Bark from Turkey
February 10, 2024 (v1)
Subject: Food & Agricultural Processes
Keywords: antioxidant, calcium, ignition temperature, suberin, ω-hydroxy acids
Taurus flowering ash (Fraxinus ornus subsp. cilicica) is an endemic tree species in Turkey. The bark of the species was characterized for summative chemical composition, the monomeric composition of polysaccharides, phenolic content, in vitro and ex vivo antioxidant properties of hydrophilic extracts, the composition of lipophilic extractives and suberin, and thermal degradation. The bark has an elevated ash content (17%), primarily composed of calcium, and a noteworthy extractive content (38.9%), predominantly of hydrophilic compounds. The antioxidant activity of the bark extracts is moderate, with an IC50 value of 40 μg/mL and an EC50 value of 230 μg/mL by DPPH and TBARS methods. The lipophilic extractives principally contain fatty acids and diterpenoids. The suberin content is low (1%) and composed primarily of ω-hydroxy acids with 9,10,18 trihydroxyoctadecanoic acid as the major suberin monomer. The lignin content is low (9.8%), and polysaccharides represent 33%. The ignition tempe... [more]