Pub Date : 2024-05-05DOI: 10.1016/j.jfueco.2024.100122
Sri Haryati , Candra Ayu Purnawati , Nurul Eka Fadhila , Muhammad Djoni Bustan , Diah Kusuma Pratiwi , Restu Juniah
Cogongrass (Imperata cylindrica) can be processed into a positive electrode as a battery component to generate electricity by utilizing its carbon element. This study used various activators, KOH and H3PO4, and characterized using XRD, FTIR, and SEM-EDX and electrical tests with electric conductivity analysis. The analysis results using XRD diffraction showed that when using both KOH and H3PO4 activators, Cogongrass carbon has graphite (C) and silicon (Si) crystals but at different peaks. The carbon has the same functional groups for both activators: OH-bending, C=C-bending, C-O-bending, and C=C-bending. Cogongrass carbon with KOH activator has a pore size of 235-980 nm with a percentage of carbon atoms of 71.29%, while with H3PO4 activator has a pore size of 110-960 nm with a higher percentage of carbon atoms of 75.04%. The elements contained in carbon are the same for both activators, namely carbon, oxygen, silicon, indium, potassium, calcium, iron, chlorine, phosphorus, magnesium, and sodium. EC analysis showed that carbon from Cogongrasss showed electric conductivity reaching 140 µs/cm at 60 minutes pyrolysis time.
{"title":"Preparation of porous carbon from Cogongrass leaves as raw material for batteries (electrical energy)","authors":"Sri Haryati , Candra Ayu Purnawati , Nurul Eka Fadhila , Muhammad Djoni Bustan , Diah Kusuma Pratiwi , Restu Juniah","doi":"10.1016/j.jfueco.2024.100122","DOIUrl":"https://doi.org/10.1016/j.jfueco.2024.100122","url":null,"abstract":"<div><p>Cogongrass (Imperata cylindrica) can be processed into a positive electrode as a battery component to generate electricity by utilizing its carbon element. This study used various activators, KOH and H<sub>3</sub>PO<sub>4,</sub> and characterized using XRD, FTIR, and SEM-EDX and electrical tests with electric conductivity analysis. The analysis results using XRD diffraction showed that when using both KOH and H<sub>3</sub>PO<sub>4</sub> activators, Cogongrass carbon has graphite (C) and silicon (Si) crystals but at different peaks. The carbon has the same functional groups for both activators: OH-bending, C=C-bending, C-O-bending, and C=C-bending. Cogongrass carbon with KOH activator has a pore size of 235-980 nm with a percentage of carbon atoms of 71.29%, while with H<sub>3</sub>PO<sub>4</sub> activator has a pore size of 110-960 nm with a higher percentage of carbon atoms of 75.04%. The elements contained in carbon are the same for both activators, namely carbon, oxygen, silicon, indium, potassium, calcium, iron, chlorine, phosphorus, magnesium, and sodium. EC analysis showed that carbon from Cogongrasss showed electric conductivity reaching 140 µs/cm at 60 minutes pyrolysis time.</p></div>","PeriodicalId":100556,"journal":{"name":"Fuel Communications","volume":"19 ","pages":"Article 100122"},"PeriodicalIF":0.0,"publicationDate":"2024-05-05","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.sciencedirect.com/science/article/pii/S2666052024000177/pdfft?md5=681bc3dc3b0b42d634902e12015fb9cf&pid=1-s2.0-S2666052024000177-main.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"140901749","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-04-28DOI: 10.1016/j.jfueco.2024.100121
Ward Suijs , Jeroen Dierickx , Yi-Hao Pu , Yuanfeng Wang , Sebastian Verhelst
Experimental test campaigns have begun to demonstrate the potential of methanol as an alternative fuel for heavy-duty spark-ignited engines. However, there is no consensus yet on the scope of this solution in terms of maximum power and engine size. A zero-dimensional combustion model is therefore being developed outside the scope of this work. Its main objective will be to predict key performance parameters such as power and efficiency as function of engine size. Due to the high loads typically encountered in heavy-duty engines, knock will be the main constraint to maximize the engine's potential. This work therefore aims to find an accurate knock model that can be implemented in the modelling framework. The Livengood–Wu knock integral model is being considered as a good candidate, as it is computationally inexpensive and thus allows for a large number of engine configurations to be modelled within a reasonable time. Due to a lack of autoignition delay times of methanol at conditions relevant to heavy-duty engines, a large database was created using chemical kinetics calculations. A neural network model was trained with the tabulated data for fast data retrieval. To validate whether the knock integral approach is robust enough to be applied to a wide range of engine sizes, a calibration constant was added to match the knock predictions to experimental data. Its value was calculated for three different engines, a light and heavy-duty SI engine and a large-bore dual-fuel engine. They highlight a remarkable difference in calibration constant across the different engines investigated.
实验测试活动已经开始证明甲醇作为重型火花点火发动机替代燃料的潜力。然而,就最大功率和发动机尺寸而言,这一解决方案的范围尚未达成共识。因此,在这项工作的范围之外,正在开发一个零维燃烧模型。其主要目的是预测关键性能参数,如功率和效率与发动机尺寸的函数关系。由于重型发动机通常会遇到高负荷,爆震将是最大限度发挥发动机潜能的主要制约因素。因此,这项工作的目标是找到一个可在建模框架中实施的精确爆震模型。Livengood-Wu 敲击积分模型被认为是一个很好的候选模型,因为它的计算成本低廉,因此可以在合理的时间内对大量发动机配置进行建模。由于缺乏甲醇在重型发动机相关工况下的自燃延迟时间,我们利用化学动力学计算建立了一个大型数据库。利用表格数据训练了一个神经网络模型,以便快速检索数据。为了验证爆震积分方法是否足够稳健,可以应用于各种尺寸的发动机,我们添加了一个校准常数,使爆震预测与实验数据相匹配。我们计算了三种不同发动机(轻型和重型 SI 发动机以及大排量双燃料发动机)的校准常数值。结果表明,不同发动机的校准常数存在显著差异。
{"title":"Calibrating the Livengood–Wu integral knock model for differently sized methanol engines","authors":"Ward Suijs , Jeroen Dierickx , Yi-Hao Pu , Yuanfeng Wang , Sebastian Verhelst","doi":"10.1016/j.jfueco.2024.100121","DOIUrl":"https://doi.org/10.1016/j.jfueco.2024.100121","url":null,"abstract":"<div><p>Experimental test campaigns have begun to demonstrate the potential of methanol as an alternative fuel for heavy-duty spark-ignited engines. However, there is no consensus yet on the scope of this solution in terms of maximum power and engine size. A zero-dimensional combustion model is therefore being developed outside the scope of this work. Its main objective will be to predict key performance parameters such as power and efficiency as function of engine size. Due to the high loads typically encountered in heavy-duty engines, knock will be the main constraint to maximize the engine's potential. This work therefore aims to find an accurate knock model that can be implemented in the modelling framework. The Livengood–Wu knock integral model is being considered as a good candidate, as it is computationally inexpensive and thus allows for a large number of engine configurations to be modelled within a reasonable time. Due to a lack of autoignition delay times of methanol at conditions relevant to heavy-duty engines, a large database was created using chemical kinetics calculations. A neural network model was trained with the tabulated data for fast data retrieval. To validate whether the knock integral approach is robust enough to be applied to a wide range of engine sizes, a calibration constant was added to match the knock predictions to experimental data. Its value was calculated for three different engines, a light and heavy-duty SI engine and a large-bore dual-fuel engine. They highlight a remarkable difference in calibration constant across the different engines investigated.</p></div>","PeriodicalId":100556,"journal":{"name":"Fuel Communications","volume":"19 ","pages":"Article 100121"},"PeriodicalIF":0.0,"publicationDate":"2024-04-28","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.sciencedirect.com/science/article/pii/S2666052024000165/pdfft?md5=044feba9689d1512e6f980bb2de91fb0&pid=1-s2.0-S2666052024000165-main.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"140825682","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-04-15DOI: 10.1016/j.jfueco.2024.100119
Namsu Kim, Young Tae Guahk, Chang-bog Ko
This study presents a numerical investigation into the effects of physical models on the prediction accuracy of the wall temperature distribution in an industrial radiant tube burner. Utilizing a reacting flow solver based on OpenFOAM, we explored the effects of various physical models, including those for chemistry, combustion, heat transfer, and radiation properties. The choice of combustion model significantly influences prediction accuracy, playing a more dominant role than the chemistry mechanism. Moreover, the simulations captured a distinctive triple flame structure inside the burner, representing the coexistence of rich premixed, non-premixed, and lean premixed flame structures. Conditional scatter plots displayed the development of both premixed and non-premixed flame structures, converging on the fuel-lean side. Notably, accurate prediction of wall temperature distribution depends on the incorporation of a precise heat transfer model, coupled with a detailed radiation property model. Regarding the distribution of tube surface temperature in the main radiation zone (a distance from the burner nozzle greater than 1 m), the most accurate prediction exhibits a maximum deviation of less than 56 K and an average deviation of 24 K compared to experimental results. The simulation closely matched experimental data for exhaust concentration of NO within an error margin of 20 ppm. However, discrepancy was observed in the CO concentration, which was attributed to the simplified representations of fuel chemistry and composition, as well as the difficulties in accurately capturing the unsteady flame dynamics near the wall.
{"title":"Numerical simulation of an industrial radiant tube burner using OpenFOAM","authors":"Namsu Kim, Young Tae Guahk, Chang-bog Ko","doi":"10.1016/j.jfueco.2024.100119","DOIUrl":"https://doi.org/10.1016/j.jfueco.2024.100119","url":null,"abstract":"<div><p>This study presents a numerical investigation into the effects of physical models on the prediction accuracy of the wall temperature distribution in an industrial radiant tube burner. Utilizing a reacting flow solver based on OpenFOAM, we explored the effects of various physical models, including those for chemistry, combustion, heat transfer, and radiation properties. The choice of combustion model significantly influences prediction accuracy, playing a more dominant role than the chemistry mechanism. Moreover, the simulations captured a distinctive triple flame structure inside the burner, representing the coexistence of rich premixed, non-premixed, and lean premixed flame structures. Conditional scatter plots displayed the development of both premixed and non-premixed flame structures, converging on the fuel-lean side. Notably, accurate prediction of wall temperature distribution depends on the incorporation of a precise heat transfer model, coupled with a detailed radiation property model. Regarding the distribution of tube surface temperature in the main radiation zone (a distance from the burner nozzle greater than 1 m), the most accurate prediction exhibits a maximum deviation of less than 56 K and an average deviation of 24 K compared to experimental results. The simulation closely matched experimental data for exhaust concentration of NO within an error margin of 20 ppm. However, discrepancy was observed in the CO concentration, which was attributed to the simplified representations of fuel chemistry and composition, as well as the difficulties in accurately capturing the unsteady flame dynamics near the wall.</p></div>","PeriodicalId":100556,"journal":{"name":"Fuel Communications","volume":"19 ","pages":"Article 100119"},"PeriodicalIF":0.0,"publicationDate":"2024-04-15","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.sciencedirect.com/science/article/pii/S2666052024000141/pdfft?md5=d84c10cf727ca5f2411cebe7af9c19ad&pid=1-s2.0-S2666052024000141-main.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"140618197","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-04-12DOI: 10.1016/j.jfueco.2024.100116
Saba Foroutan Ghazvini, Elena Ivashkina Nikolaevna
The work aims to determine the kinetic parameters of reactions for production of light olefins via catalytic cracking reactions of C4–C6 n-alkanes based on the energy characteristics of the transition state using quantum chemical calculations. Cracking reactions of C4–C6 n-alkanes proceed via protolytic mechanism on the Brønsted acid sites of zeolite-containing catalysts. For kinetic studies in this work, the thermochemical parameters of the intermediate stages, including hydrocarbon adsorption and transition state were determined, then the activation energies and rate constants were determined over the temperature range of catalytic cracking process from 773 to 903 K (500–630 °C).
The results showed that DFT method in combination with B3LYP and ωB97X-D functionals, and 3–21 G basis demonstrated quite high accuracy in determining thermochemical parameters, including enthalpy, entropy and Gibbs free energy at both energetic levels of adsorption and transition state. Then, modeling continued by calculations of activation energies and rate constants of reactions. Obtained kinetic parameters made it possible to determine the reactivity of hydrocarbons with different chain length. It was obtained that the rate constants of butane cracking reactions with the formation of ethylene are 54–90 times higher than the formation of propylene. The rate constants of pentane cracking reactions with the formation of butylene are on average 5 times higher than the formation of propylene. The rate constants for hexane cracking reactions with the formation of butylene are 2.9–3.7 times higher compared to the formation of propylene.
{"title":"Kinetic analysis of monomolecular cracking of normal Alkanes (C4C6) over Brønsted Acid site of Zeolitic type catalyst with energetic evaluation of transition states using Quantum-Chemical modeling","authors":"Saba Foroutan Ghazvini, Elena Ivashkina Nikolaevna","doi":"10.1016/j.jfueco.2024.100116","DOIUrl":"https://doi.org/10.1016/j.jfueco.2024.100116","url":null,"abstract":"<div><p>The work aims to determine the kinetic parameters of reactions for production of light olefins via catalytic cracking reactions of C<sub>4</sub>–C<sub>6</sub> n-alkanes based on the energy characteristics of the transition state using quantum chemical calculations. Cracking reactions of C<sub>4</sub>–C<sub>6</sub> n-alkanes proceed via protolytic mechanism on the Brønsted acid sites of zeolite-containing catalysts. For kinetic studies in this work, the thermochemical parameters of the intermediate stages, including hydrocarbon adsorption and transition state were determined, then the activation energies and rate constants were determined over the temperature range of catalytic cracking process from 773 to 903 K (500–630 °C).</p><p>The results showed that DFT method in combination with B3LYP and ωB97X-D functionals, and 3–21 G basis demonstrated quite high accuracy in determining thermochemical parameters, including enthalpy, entropy and Gibbs free energy at both energetic levels of adsorption and transition state. Then, modeling continued by calculations of activation energies and rate constants of reactions. Obtained kinetic parameters made it possible to determine the reactivity of hydrocarbons with different chain length. It was obtained that the rate constants of butane cracking reactions with the formation of ethylene are 54–90 times higher than the formation of propylene. The rate constants of pentane cracking reactions with the formation of butylene are on average 5 times higher than the formation of propylene. The rate constants for hexane cracking reactions with the formation of butylene are 2.9–3.7 times higher compared to the formation of propylene.</p></div>","PeriodicalId":100556,"journal":{"name":"Fuel Communications","volume":"19 ","pages":"Article 100116"},"PeriodicalIF":0.0,"publicationDate":"2024-04-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.sciencedirect.com/science/article/pii/S2666052024000116/pdfft?md5=738428c02da00fdc16ecbcfde8694dde&pid=1-s2.0-S2666052024000116-main.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"140555483","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-04-10DOI: 10.1016/j.jfueco.2024.100117
G. Lemmi , S. Castellani , P.C. Nassini , A. Picchi , S. Galeotti , R. Becchi , A. Andreini , G. Babazzi , R. Meloni
In the pursuit of decarbonization, the reduction of greenhouse gas emissions from power generation through gas turbine (GT) engines plays a crucial role in the whole industrial sector. As industries strive to transition towards cleaner energy sources, the design and optimization of novel GT burners require a deep comprehension of the complex interaction between fluid dynamics and combustion processes embedded within the system. Computational Fluid Dynamics (CFD) plays a pivotal role in these processes by providing valuable insights into the complex flow patterns, flame topology, and stability limits within the combustor. Concurrently, the burner design phase necessitates a considerable number of simulations to ascertain flame stability limits under various burner designs and operating conditions. Therefore, it is imperative to control computational costs while ensuring a high level of accuracy. The present work is focused on a comprehensive comparative analysis of two widely employed turbulent combustion closure models: the Flamelet Generated Manifold (FGM) and the Artificially Thickened Flame (ATF). Both models utilize extended versions with specific modifications aimed at effectively addressing their respective limitations. The investigation is performed through a Large Eddy Simulation (LES) based CFD analysis within the context of a lean premixed burner designed by Baker Hughes and operated with methane at atmospheric pressure. The primary benchmark for numerical validation will be provided by detailed chemiluminescence images from a test campaign conducted by the University of Florence, thereby yielding valuable insights into flame topology and positioning. Furthermore, potential disparities in the flow field and fuel concentration at the burner exit between the two models will be revealed.
{"title":"FGM vs ATF: A comparative LES analysis in predicting the flame characteristics of an industrial lean premixed burner for gas turbine applications","authors":"G. Lemmi , S. Castellani , P.C. Nassini , A. Picchi , S. Galeotti , R. Becchi , A. Andreini , G. Babazzi , R. Meloni","doi":"10.1016/j.jfueco.2024.100117","DOIUrl":"10.1016/j.jfueco.2024.100117","url":null,"abstract":"<div><p>In the pursuit of decarbonization, the reduction of greenhouse gas emissions from power generation through gas turbine (GT) engines plays a crucial role in the whole industrial sector. As industries strive to transition towards cleaner energy sources, the design and optimization of novel GT burners require a deep comprehension of the complex interaction between fluid dynamics and combustion processes embedded within the system. Computational Fluid Dynamics (CFD) plays a pivotal role in these processes by providing valuable insights into the complex flow patterns, flame topology, and stability limits within the combustor. Concurrently, the burner design phase necessitates a considerable number of simulations to ascertain flame stability limits under various burner designs and operating conditions. Therefore, it is imperative to control computational costs while ensuring a high level of accuracy. The present work is focused on a comprehensive comparative analysis of two widely employed turbulent combustion closure models: the Flamelet Generated Manifold (FGM) and the Artificially Thickened Flame (ATF). Both models utilize extended versions with specific modifications aimed at effectively addressing their respective limitations. The investigation is performed through a Large Eddy Simulation (LES) based CFD analysis within the context of a lean premixed burner designed by Baker Hughes and operated with methane at atmospheric pressure. The primary benchmark for numerical validation will be provided by detailed chemiluminescence images from a test campaign conducted by the University of Florence, thereby yielding valuable insights into flame topology and positioning. Furthermore, potential disparities in the flow field and fuel concentration at the burner exit between the two models will be revealed.</p></div>","PeriodicalId":100556,"journal":{"name":"Fuel Communications","volume":"19 ","pages":"Article 100117"},"PeriodicalIF":0.0,"publicationDate":"2024-04-10","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.sciencedirect.com/science/article/pii/S2666052024000128/pdfft?md5=96c7f51e290146aaae70c65872ff685a&pid=1-s2.0-S2666052024000128-main.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"140759042","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-04-09DOI: 10.1016/j.jfueco.2024.100115
Magdalini Tsarpali , John N. Kuhn , George P. Philippidis
Chemical activation was employed to convert algal biochar obtained from hydrothermal carbonization of lipid-extracted algae (LEA) to activated carbon. Potassium hydroxide, previously utilized on cellulosic biomass but not on algal biomass, was employed as activating agent and the impact of the activation conditions, namely temperature, activation time, and amount of activating agent, were investigated. The yield of activated carbon from biochar ranged from 28 % to 52% and decreased as the temperature was raised from 400 to 600 °C, the residence time from 30 to 60 min, and the KOH/biochar mass ratio from 0.25 to 1.0. In contrast, surface area increased by 2.1-fold when the activation temperature was raised to 600 °C and by 1.5-fold when the KOH: biochar ratio was raised to 1.0. Maximum BET surface area of 847 m2/g was achieved at 600 °C after 30 min at a mass ratio of 1:1. The integrated hydrothermal carbonization and activation process of LEA was simulated in Aspen Plus® and the technoeconomic feasibility was assessed based on our experimental data at 1,000 and 10,000 acres of cultivation area. For the latter, net present value analysis determined a minimum selling price of $2,200/ton for algal activated carbon with a financial breakeven achieved in 3.5 years. This is cost-competitive with the current price of commercial fossil-derived activated carbon, which is $1,543-$2,645/ton. Sensitivity analysis showed that the minimum selling price is significantly affected by algal biomass yield during cultivation and is more sensitive to the operating expenses than to the capital investment.
{"title":"Activated carbon production from algal biochar: Chemical activation and feasibility analysis","authors":"Magdalini Tsarpali , John N. Kuhn , George P. Philippidis","doi":"10.1016/j.jfueco.2024.100115","DOIUrl":"https://doi.org/10.1016/j.jfueco.2024.100115","url":null,"abstract":"<div><p>Chemical activation was employed to convert algal biochar obtained from hydrothermal carbonization of lipid-extracted algae (LEA) to activated carbon. Potassium hydroxide, previously utilized on cellulosic biomass but not on algal biomass, was employed as activating agent and the impact of the activation conditions, namely temperature, activation time, and amount of activating agent, were investigated. The yield of activated carbon from biochar ranged from 28 % to 52% and decreased as the temperature was raised from 400 to 600 °C, the residence time from 30 to 60 min, and the KOH/biochar mass ratio from 0.25 to 1.0. In contrast, surface area increased by 2.1-fold when the activation temperature was raised to 600 °C and by 1.5-fold when the KOH: biochar ratio was raised to 1.0. Maximum BET surface area of 847 m<sup>2</sup>/g was achieved at 600 °C after 30 min at a mass ratio of 1:1. The integrated hydrothermal carbonization and activation process of LEA was simulated in Aspen Plus® and the technoeconomic feasibility was assessed based on our experimental data at 1,000 and 10,000 acres of cultivation area. For the latter, net present value analysis determined a minimum selling price of $2,200/ton for algal activated carbon with a financial breakeven achieved in 3.5 years. This is cost-competitive with the current price of commercial fossil-derived activated carbon, which is $1,543-$2,645/ton. Sensitivity analysis showed that the minimum selling price is significantly affected by algal biomass yield during cultivation and is more sensitive to the operating expenses than to the capital investment.</p></div>","PeriodicalId":100556,"journal":{"name":"Fuel Communications","volume":"19 ","pages":"Article 100115"},"PeriodicalIF":0.0,"publicationDate":"2024-04-09","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.sciencedirect.com/science/article/pii/S2666052024000104/pdfft?md5=91c3a397a9b39e65ed29d9439e9c8a21&pid=1-s2.0-S2666052024000104-main.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"140543339","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-04-08DOI: 10.1016/j.jfueco.2024.100114
Curtis D. Davis , Shravan Sreekumar , Richard Altman , Andres F. Clarens , James H. Lambert , Lisa M. Colosi
There is strong interest in sustainable aviation fuels (SAF) to decarbonize aviation; however, local decision-makers will need to consider what additional incentives could stimulate SAF commercialization within their own jurisdictions. This study analyzed SAF production in Virginia, evaluating two biomass-to-energy platforms (gasification Fischer Tropsch [GFT] and pyrolysis) and two regionally abundant feedstocks (woody wastes and municipal solid wastes). A suite of open-access modeling tools were applied to possible SAF supply chains encompassing feedstock collection and transportation, conversion, and fuel upgrading and transport. Key modeling outputs were minimum product selling price (MPSP) ($/gallon) and life-cycle global warming potential (GWP) (g CO2eq/MJ). Results suggest that early SAF production via GFT will require local incentives of approximately $3.61 per gallon compared to $0.75 per gallon for pilot-scale pyrolysis. Location of production facility (by county) influences economic and environmental metrics but is not nearly as important as facility size (tonnes/year). Different formats of financial incentives (i.e., tax credits, loan forgiveness, etc.) offer markedly different reductions in SAF MPSP. Finally, under current federal incentives in the US, it is still more economically efficient to use pyrolysis (with higher GWP) than GFT (with lower GWP). Therefore, regional stakeholders will need to navigate the tradeoff between economic and environmental performances of these platforms. Though Virginia was used as a case study, the methodology is replicable for other jurisdictions, insofar it can be adapted for use in other locations without decision-makers having to completely build their own TEA models.
人们对可持续航空燃料(SAF)以实现航空脱碳有着浓厚的兴趣;然而,地方决策者需要考虑哪些额外的激励措施可以在其管辖范围内促进 SAF 的商业化。本研究分析了弗吉尼亚州的 SAF 生产情况,评估了两种生物质转化为能源的平台(气化费托合成(GFT)和热解)以及两种地区丰富的原料(木质废料和城市固体废弃物)。一套开放式建模工具被应用于可能的 SAF 供应链,其中包括原料收集和运输、转化以及燃料升级和运输。主要建模输出为最低产品售价(MPSP)(美元/加仑)和生命周期全球升温潜能值(GWP)(克 CO2eq/兆焦耳)。结果表明,通过 GFT 生产早期 SAF 所需的地方奖励约为每加仑 3.61 美元,而试点规模的热解则为每加仑 0.75 美元。生产设施的位置(按县划分)会影响经济和环境指标,但其重要性远不及设施规模(吨/年)。不同形式的财政激励措施(如税收减免、贷款减免等)对 SAF MPSP 的减排效果明显不同。最后,在美国当前的联邦激励机制下,使用热解(全球升温潜能值较高)比使用 GFT(全球升温潜能值较低 )更具经济效益。因此,地区利益相关者需要在这些平台的经济和环境性能之间进行权衡。虽然弗吉尼亚州被用作案例研究,但该方法可在其他地区复制,因为决策者无需完全建立自己的 TEA 模型即可在其他地区使用。
{"title":"Geospatially explicit technoeconomic assessment of sustainable aviation fuel production: A regional case study in Virginia","authors":"Curtis D. Davis , Shravan Sreekumar , Richard Altman , Andres F. Clarens , James H. Lambert , Lisa M. Colosi","doi":"10.1016/j.jfueco.2024.100114","DOIUrl":"https://doi.org/10.1016/j.jfueco.2024.100114","url":null,"abstract":"<div><p>There is strong interest in sustainable aviation fuels (SAF) to decarbonize aviation; however, local decision-makers will need to consider what additional incentives could stimulate SAF commercialization within their own jurisdictions. This study analyzed SAF production in Virginia, evaluating two biomass-to-energy platforms (gasification Fischer Tropsch [GFT] and pyrolysis) and two regionally abundant feedstocks (woody wastes and municipal solid wastes). A suite of open-access modeling tools were applied to possible SAF supply chains encompassing feedstock collection and transportation, conversion, and fuel upgrading and transport. Key modeling outputs were minimum product selling price (MPSP) ($/gallon) and life-cycle global warming potential (GWP) (g CO<sub>2</sub>eq/MJ). Results suggest that early SAF production via GFT will require local incentives of approximately $3.61 per gallon compared to $0.75 per gallon for pilot-scale pyrolysis. Location of production facility (by county) influences economic and environmental metrics but is not nearly as important as facility size (tonnes/year). Different formats of financial incentives (i.e., tax credits, loan forgiveness, etc.) offer markedly different reductions in SAF MPSP. Finally, under current federal incentives in the US, it is still more economically efficient to use pyrolysis (with higher GWP) than GFT (with lower GWP). Therefore, regional stakeholders will need to navigate the tradeoff between economic and environmental performances of these platforms. Though Virginia was used as a case study, the methodology is replicable for other jurisdictions, insofar it can be adapted for use in other locations without decision-makers having to completely build their own TEA models.</p></div>","PeriodicalId":100556,"journal":{"name":"Fuel Communications","volume":"19 ","pages":"Article 100114"},"PeriodicalIF":0.0,"publicationDate":"2024-04-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.sciencedirect.com/science/article/pii/S2666052024000098/pdfft?md5=c1947dc1083debfb7087e9bec740e6cc&pid=1-s2.0-S2666052024000098-main.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"140545908","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-03-28DOI: 10.1016/j.jfueco.2024.100113
F. Di Lauro , A. Amadei , M. Balsamo , M. Damizia , B. de Caprariis , P. De Filippis , R. Solimene , P. Salatino , F. Montagnaro
This study scrutinizes the effect of the heating rate obtained in two reactors of different volume (10 mL and 500 mL) on the production of bio-crude during the hydrothermal liquefaction (HTL) process applied to sludges of different nature: a municipal, a paper mill and an agricultural sludge. The effect of the reactor scale on the chemical composition of the bio-crude and the solid residue (co-product of HTL process) is also evaluated by elemental, GC–MS and FT-IR analysis. Results suggest that different heating rates along HTL exert an almost negligible influence on the bio-crude yield and limited effect on the chemical composition when the reaction time under the isothermal conditions is kept at 10 min. In fact, regardless of the heating rate, the bio-crude yields on dry basis from municipal, paper mill and agricultural sludges are equal to 21 %, 21 % and 12 %, respectively. These results could be explained with the different reactive pathway and kinetics of the sludges macro-components.
{"title":"Effect of the reactor heating rate on bio-crude yield and quality from hydrothermal liquefaction of different sludge","authors":"F. Di Lauro , A. Amadei , M. Balsamo , M. Damizia , B. de Caprariis , P. De Filippis , R. Solimene , P. Salatino , F. Montagnaro","doi":"10.1016/j.jfueco.2024.100113","DOIUrl":"https://doi.org/10.1016/j.jfueco.2024.100113","url":null,"abstract":"<div><p>This study scrutinizes the effect of the heating rate obtained in two reactors of different volume (10 mL and 500 mL) on the production of bio-crude during the hydrothermal liquefaction (HTL) process applied to sludges of different nature: a municipal, a paper mill and an agricultural sludge. The effect of the reactor scale on the chemical composition of the bio-crude and the solid residue (co-product of HTL process) is also evaluated by elemental, GC–MS and FT-IR analysis. Results suggest that different heating rates along HTL exert an almost negligible influence on the bio-crude yield and limited effect on the chemical composition when the reaction time under the isothermal conditions is kept at 10 min. In fact, regardless of the heating rate, the bio-crude yields on dry basis from municipal, paper mill and agricultural sludges are equal to 21 %, 21 % and 12 %, respectively. These results could be explained with the different reactive pathway and kinetics of the sludges macro-components.</p></div>","PeriodicalId":100556,"journal":{"name":"Fuel Communications","volume":"19 ","pages":"Article 100113"},"PeriodicalIF":0.0,"publicationDate":"2024-03-28","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.sciencedirect.com/science/article/pii/S2666052024000086/pdfft?md5=9bd9faf599a0701f214fc3924315bfb8&pid=1-s2.0-S2666052024000086-main.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"140345353","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-03-27DOI: 10.1016/j.jfueco.2024.100112
Andrew R. Demko , Justin A. Lajoie , Alexander R. Jimenez-Thomas , David J. Ramirez , Travis R. Sippel
Ammonium perchlorate (AP) has been the oxidizer of choice for composite solid propellants for decades and has been the object of decomposition studies for safety monitoring. Typically, studies perform differential scanning calorimetry (DSC) or thermogravimetric analysis (TGA) to show how metal oxides (MO) commonly incorporated into propellants alter AP decomposition rates and completeness of reaction. Most past decomposition work studies temperatures below the crystal phase transition (240°C) from orthorhombic phase to cubic, which impose internal stresses within the lattice of AP particles. Phase change induces a partial decomposition, which does not follow a shrinking core behavior; instead, it develops a network of pores up to a few microns in size throughout. During low-temperature decomposition, particles lose approximately 30-40 % of their mass. Simultaneous DSC/TGA (STA) use low heating rates for combustion environments but offer information on MO's catalytic and electron transport modifications. This work demonstrates how the crystalline morphology MO additives mechanistically alter the combustion properties of composite propellants by identifying modes for promoting decomposition in AP and HTPB. MO morphology determines the electron structure of the molecule, which sets the band gap properties of the particles. This study evaluated different morphologies and a range of MOs to identify the most active MO for decomposing A.P. Kissinger analysis was applied using STA data at heating rates of 10-, 20-, and 30-°C/min revealing significant shift in the high-temperature decomposition with a range of metal oxides. Higher heating rates were evaluated using CO2 laser ignition to identify the time to first gas using the MO that offers the best heat absorption, such as the aluminum oxides. This higher heating rate was found do more accurately represent the changes in the combustion rates in the final propellant mixture. Additionally, it was shown that electron transport additives like CuO show the most significant impact on combustion, and thermal absorbers offer the lowest impact on AP/HTPB combustion. This understanding offers a new approach to propellant design not previously presented and suggests future testing for tailoring the use of metal oxides in propellants.
几十年来,高氯酸铵(AP)一直是复合固体推进剂的首选氧化剂,也一直是安全监测分解研究的对象。通常,研究采用差示扫描量热法 (DSC) 或热重分析法 (TGA) 来显示推进剂中常见的金属氧化物 (MO) 如何改变 AP 的分解速率和反应完整性。过去的大多数分解工作研究的温度都低于从正方晶相到立方晶相的晶体相变温度(240°C),这在 AP 颗粒晶格内造成了内应力。相变会引起部分分解,这种分解并不遵循核心收缩的行为,而是在整个分解过程中形成一个孔隙网络,孔隙大小可达几微米。在低温分解过程中,颗粒会损失大约 30-40% 的质量。同时 DSC/TGA (STA) 对燃烧环境的加热速率较低,但可提供有关 MO 催化和电子传输修饰的信息。这项研究通过确定促进 AP 和 HTPB 分解的模式,展示了晶体形态 MO 添加剂如何从机理上改变复合推进剂的燃烧特性。MO 形态决定了分子的电子结构,而电子结构又决定了颗粒的带隙特性。本研究对不同的形态和一系列 MO 进行了评估,以确定分解 A.P.最活跃的 MO。利用加热速率为 10、20 和 30°C/min 时的 STA 数据进行了基辛格分析,结果显示一系列金属氧化物的高温分解发生了显著变化。使用 CO2 激光点火对更高的加热速率进行了评估,以确定使用铝氧化物等吸热效果最好的金属氧化物的初气时间。结果发现,这种较高的加热速率能更准确地反映最终推进剂混合物中燃烧速率的变化。此外,研究还表明,氧化铜等电子传输添加剂对燃烧的影响最大,而热吸收剂对 AP/HTPB 燃烧的影响最小。这一认识为推进剂设计提供了一种以前未曾提出过的新方法,并建议今后对推进剂中金属氧化物的使用进行定制测试。
{"title":"Impacts of metal oxide crystalline structure on the decomposition of solid propellants under combustion heating rates","authors":"Andrew R. Demko , Justin A. Lajoie , Alexander R. Jimenez-Thomas , David J. Ramirez , Travis R. Sippel","doi":"10.1016/j.jfueco.2024.100112","DOIUrl":"https://doi.org/10.1016/j.jfueco.2024.100112","url":null,"abstract":"<div><p>Ammonium perchlorate (AP) has been the oxidizer of choice for composite solid propellants for decades and has been the object of decomposition studies for safety monitoring. Typically, studies perform differential scanning calorimetry (DSC) or thermogravimetric analysis (TGA) to show how metal oxides (MO) commonly incorporated into propellants alter AP decomposition rates and completeness of reaction. Most past decomposition work studies temperatures below the crystal phase transition (240°C) from orthorhombic phase to cubic, which impose internal stresses within the lattice of AP particles. Phase change induces a partial decomposition, which does not follow a shrinking core behavior; instead, it develops a network of pores up to a few microns in size throughout. During low-temperature decomposition, particles lose approximately 30-40 % of their mass. Simultaneous DSC/TGA (STA) use low heating rates for combustion environments but offer information on MO's catalytic and electron transport modifications. This work demonstrates how the crystalline morphology MO additives mechanistically alter the combustion properties of composite propellants by identifying modes for promoting decomposition in AP and HTPB. MO morphology determines the electron structure of the molecule, which sets the band gap properties of the particles. This study evaluated different morphologies and a range of MOs to identify the most active MO for decomposing A.P. Kissinger analysis was applied using STA data at heating rates of 10-, 20-, and 30-°C/min revealing significant shift in the high-temperature decomposition with a range of metal oxides. Higher heating rates were evaluated using CO<sub>2</sub> laser ignition to identify the time to first gas using the MO that offers the best heat absorption, such as the aluminum oxides. This higher heating rate was found do more accurately represent the changes in the combustion rates in the final propellant mixture. Additionally, it was shown that electron transport additives like CuO show the most significant impact on combustion, and thermal absorbers offer the lowest impact on AP/HTPB combustion. This understanding offers a new approach to propellant design not previously presented and suggests future testing for tailoring the use of metal oxides in propellants.</p></div>","PeriodicalId":100556,"journal":{"name":"Fuel Communications","volume":"19 ","pages":"Article 100112"},"PeriodicalIF":0.0,"publicationDate":"2024-03-27","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.sciencedirect.com/science/article/pii/S2666052024000074/pdfft?md5=61506a0759d17c91f4a7bb88c0aaaab3&pid=1-s2.0-S2666052024000074-main.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"140348231","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-03-24DOI: 10.1016/j.jfueco.2024.100111
Jassinnee Milano , Hwai Chyuan Ong , Zhi Chao Ong , Ghasem Ghadyani , Zubaidah Binti Ismail , Ibham Veza , A. Masudi , Sieh Kiong Tiong , A.S. Silitonga
Nanoparticles are being used as additives for solid and liquid fuels owing to their high specific surface area (high reactivity) and potential ability to store energy in surfaces. The use of nanoparticles in diesels, biodiesels, and their blends is a novel area with unrealised potential owing to the higher catalytic activity of nanoparticles compared with that of micro-sized materials Nanoparticles have been shown to disperse more evenly in fuels and exhibit high stability. In addition, nanoparticles in similar media burn faster than micro-sized particles. The addition of nanoparticles into diesel, biodiesels, and their blends affect the physicochemical properties of the fuels such as kinematic viscosity, density, flash point, and cetane number. Studies have shown that nanoparticles affect the brake specific fuel consumption, brake specific energy consumption, and brake thermal efficiency, depending on the dosage and type of nanoparticles. Studies have also shown that the addition of nanoparticles affect carbon monoxide, carbon dioxide, nitrogen oxide, and unburned hydrocarbon emissions, along with smoke opacity. This review presents the application of various types of nanoparticles in diesel, biodiesels, and their blends to enhance the physicochemical properties of the fuels, combustion efficiency, and engine performance, and reduce harmful exhaust emissions. It is believed that this review will be beneficial to scholars, researchers, and industrial practitioners looking forward to improve diesel engine performance and reduce exhaust emissions by exploiting nanotechnology.
{"title":"Strategies in the application of nanoadditives to achieve high-performance diesel, biodiesels, and their blends","authors":"Jassinnee Milano , Hwai Chyuan Ong , Zhi Chao Ong , Ghasem Ghadyani , Zubaidah Binti Ismail , Ibham Veza , A. Masudi , Sieh Kiong Tiong , A.S. Silitonga","doi":"10.1016/j.jfueco.2024.100111","DOIUrl":"10.1016/j.jfueco.2024.100111","url":null,"abstract":"<div><p>Nanoparticles are being used as additives for solid and liquid fuels owing to their high specific surface area (high reactivity) and potential ability to store energy in surfaces. The use of nanoparticles in diesels, biodiesels, and their blends is a novel area with unrealised potential owing to the higher catalytic activity of nanoparticles compared with that of micro-sized materials Nanoparticles have been shown to disperse more evenly in fuels and exhibit high stability. In addition, nanoparticles in similar media burn faster than micro-sized particles. The addition of nanoparticles into diesel, biodiesels, and their blends affect the physicochemical properties of the fuels such as kinematic viscosity, density, flash point, and cetane number. Studies have shown that nanoparticles affect the brake specific fuel consumption, brake specific energy consumption, and brake thermal efficiency, depending on the dosage and type of nanoparticles. Studies have also shown that the addition of nanoparticles affect carbon monoxide, carbon dioxide, nitrogen oxide, and unburned hydrocarbon emissions, along with smoke opacity. This review presents the application of various types of nanoparticles in diesel, biodiesels, and their blends to enhance the physicochemical properties of the fuels, combustion efficiency, and engine performance, and reduce harmful exhaust emissions. It is believed that this review will be beneficial to scholars, researchers, and industrial practitioners looking forward to improve diesel engine performance and reduce exhaust emissions by exploiting nanotechnology.</p></div>","PeriodicalId":100556,"journal":{"name":"Fuel Communications","volume":"19 ","pages":"Article 100111"},"PeriodicalIF":0.0,"publicationDate":"2024-03-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.sciencedirect.com/science/article/pii/S2666052024000062/pdfft?md5=1d6f400db2d555fe73b26f1c84412fab&pid=1-s2.0-S2666052024000062-main.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"140405023","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}