Exploring the pyrolysis of Agave species as a novel bioenergy source: Thermo-kinetics, modeling, and product composition insights

IF 6.2 2区 化学 Q1 CHEMISTRY, ANALYTICAL Journal of Analytical and Applied Pyrolysis Pub Date : 2025-02-20 DOI:10.1016/j.jaap.2025.107053
Jean Constantino Gomes da Silva , Santiago Arias , José Geraldo A. Pacheco , Fábio Trigo Raya , Gonçalo Amarante Guimarães Pereira , Gustavo Mockaitis
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Abstract

The Agave economic chain generates a significant waste, which has potential for sustainable bioenergy through pyrolysis. However, the diversity and heterogeneity of chemical composition of Agave species may pose challenges. This study investigates the impact of species heterogeneity on the pyrolysis of three Agave species (Agave sisalana, Agave tequilana, and Agave wercklei), aiming to correlate pyrolysis and biomass properties. Solid characterization and Py-GC/MS were used to understand Agave physicochemical characteristics and organic group distribution in volatiles, respectively. A multi-step model and advanced numerical methods were employed for the kinetic study. The physicochemical characteristics showed similar values but a distinct distribution of inorganic compounds, predominantly composed of alkali and alkaline earth metals (6–11 %w.b.), potentially influencing the organic groups’ distribution in the volatiles. High relative areas of aliphatic components (13–28 % at 773 K and 16–36 % at 873 K) and low quantity of acidic groups (<2 %) could be attributed to the catalytic deoxygenation promoted by alkali and alkaline earth metals. These findings are significant for future application of Agave in bio-oil production by pyrolysis, as commercial biomasses often yield a high content of oxygenated and acid groups. For the kinetic study, six decomposition profiles were identified in the pyrolysis, encompassing the decomposition of extractives, saponins, lignocellulose, and oxalate salts. The similarity in profiles resulted in approximately equivalent kinetic parameter values and mechanisms among the species. The average values of Ea ranged from 71 to 324 kJ mol−1, k0 values varied between 107-1022, and the reaction mechanisms included n-order and Avrami-Erofeyev types. The validity of the parameters was verified through curve reconstruction. The inorganic composition was chosen as the parameter related to pyrolysis characteristics, as it was the only parameter that differed significantly among the species. Based on the data, normalization and the proposed model demonstrated satisfactory values of R² (>0.9251), QOF (>94 %), and MSE (<2.73 ×10−3). This underscores the model's potential to describe decomposition profiles solely based on knowledge of inorganic composition, regardless of selected Agave species.
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探索龙舌兰的热解作为一种新的生物能源:热动力学,建模,和产品组成的见解
龙舌兰经济链产生了大量的废物,这些废物有可能通过热解成为可持续的生物能源。然而,龙舌兰属植物化学成分的多样性和异质性给其研究带来了挑战。本文研究了龙舌兰(Agave sisalana)、龙舌兰(Agave tequilana)和龙舌兰(Agave wercklei)三种龙舌兰(Agave sisalana)的物种异质性对其热解的影响,旨在建立其热解与生物量特性的关联。利用固体表征和Py-GC/MS分别了解龙舌兰的理化特性和挥发物中有机基团的分布。采用多步模型和先进的数值方法进行动力学研究。物理化学特征值相似,但无机化合物的分布明显,主要由碱金属和碱土金属组成(6-11 % w.b.s),可能影响挥发物中有机基团的分布。在773 K和873 K下,脂肪族组分的相对面积分别为13-28 %和16-36 %,而酸性基团的相对面积较少(<2 %)可归因于碱和碱土金属的催化脱氧作用。这些发现对于龙舌兰在热解生产生物油中的应用具有重要意义,因为商业生物质通常会产生高含量的含氧和酸性基团。在动力学研究中,确定了热解过程中的六种分解谱,包括萃取物、皂苷、木质纤维素和草酸盐的分解。在剖面上的相似性导致物种之间的动力学参数值和机理近似等效。Ea的平均值为71 ~ 324 kJ mol−1,k0的平均值为107 ~ 1022,反应机制包括n级和Avrami-Erofeyev型。通过曲线重构验证了参数的有效性。选择无机组分作为与热解特性相关的参数,因为它是唯一一个在物种间存在显著差异的参数。根据数据,归一化和所提出的模型显示出令人满意的R²(>0.9251), QOF (>94 %)和MSE (<2.73 ×10−3)值。这强调了该模型仅基于无机成分知识来描述分解剖面的潜力,而不考虑所选择的龙舌兰种类。
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来源期刊
CiteScore
9.10
自引率
11.70%
发文量
340
审稿时长
44 days
期刊介绍: The Journal of Analytical and Applied Pyrolysis (JAAP) is devoted to the publication of papers dealing with innovative applications of pyrolysis processes, the characterization of products related to pyrolysis reactions, and investigations of reaction mechanism. To be considered by JAAP, a manuscript should present significant progress in these topics. The novelty must be satisfactorily argued in the cover letter. A manuscript with a cover letter to the editor not addressing the novelty is likely to be rejected without review.
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