Manickam Minakshi, Apsana Sharma, Ferdous Sohel, Almantas Pivrikas, Pragati A. Shinde, Katsuhiko Ariga, Lok Kumar Shrestha
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The trained ML model evaluates the influence of factors such as biomass type, electrolyte, activating agent, and key synthesis parameters, including activation and carbonization temperatures and durations, on supercapacitor performance. Despite growing interest, comprehensive studies that correlate these variables with performance metrics remain limited. This work addresses this gap by using ML algorithms to uncover the interrelationships between biomass-derived carbon properties, synthesis conditions, and specific capacitance. Herein, it is demonstrated that an optimal combination of a carbonized honeydew peel to H<sub>3</sub>PO<sub>4</sub> ratio of 1:4 and an activation temperature of 500 °C yields a highly porous carbon material. When used in a symmetric device with 1 M H<sub>2</sub>SO<sub>4</sub> electrolyte, this material, rich in oxygen and phosphorus species, achieves a high specific capacitance of 611 F g<sup>−1</sup> at a current density of 1.3 A g<sup>−1</sup>. 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引用次数: 0
摘要
生物质衍生的多孔碳电极由于其可持续性、成本效益和可调孔隙率而引起了高性能超级电容器应用的极大关注。为了加速这些材料的设计和评估,必须制定准确有效的策略来优化其物理化学和电化学性能。本文采用机器学习(ML)方法来分析先前报道来源的实验数据,从而能够根据各种材料特性和加工条件预测比电容(gf -1)。训练后的ML模型评估了生物质类型、电解质、活化剂和关键合成参数(包括活化和碳化温度和持续时间)等因素对超级电容器性能的影响。尽管越来越多的人感兴趣,但将这些变量与性能指标联系起来的综合研究仍然有限。这项工作通过使用ML算法来揭示生物质衍生碳性质、合成条件和比电容之间的相互关系,从而解决了这一差距。本研究表明,在炭化的蜜瓜皮与H3PO4的比例为1:4、活化温度为500℃的最佳组合下,可以得到高多孔碳材料。当在对称器件中使用1 M H2SO4电解液时,该材料富含氧和磷,在1.3 a g-1电流密度下可获得611 F -1的高比电容。相关分析表明,比表面积与孔隙体积之间存在较强的协同效应(相关系数= 0.8473),ml预测的电容与实验结果吻合较好。这种机器学习辅助的框架为控制超级电容器性能的关键物理化学和电化学参数提供了有价值的见解,为合理设计下一代储能材料提供了有力的工具。
Machine Learning—Guided Design of Biomass-Based Porous Carbon for Aqueous Symmetric Supercapacitors
Biomass-derived porous carbon electrodes have attracted significant attention for high-performance supercapacitor applications due to their sustainability, cost-effectiveness, and tunable porosity. To accelerate the design and evaluation of these materials, it is essential to develop accurate and efficient strategies for optimizing their physicochemical and electrochemical properties. Herein, a machine learning (ML) approach is employed to analyze experimental data from previously reported sources, enabling the prediction of specific capacitance (F g−1) based on various material characteristics and processing conditions. The trained ML model evaluates the influence of factors such as biomass type, electrolyte, activating agent, and key synthesis parameters, including activation and carbonization temperatures and durations, on supercapacitor performance. Despite growing interest, comprehensive studies that correlate these variables with performance metrics remain limited. This work addresses this gap by using ML algorithms to uncover the interrelationships between biomass-derived carbon properties, synthesis conditions, and specific capacitance. Herein, it is demonstrated that an optimal combination of a carbonized honeydew peel to H3PO4 ratio of 1:4 and an activation temperature of 500 °C yields a highly porous carbon material. When used in a symmetric device with 1 M H2SO4 electrolyte, this material, rich in oxygen and phosphorus species, achieves a high specific capacitance of 611 F g−1 at a current density of 1.3 A g−1. Correlation analysis reveals a strong synergy between surface area and pore volume (correlation coefficient = 0.8473), and the ML-predicted capacitance closely aligns with experimental results. This ML-assisted framework offers valuable insights into the critical physicochemical and electrochemical parameters that govern supercapacitor performance, providing a powerful tool for the rational design of next-generation energy storage materials.
期刊介绍:
ChemPlusChem is a peer-reviewed, general chemistry journal that brings readers the very best in multidisciplinary research centering on chemistry. It is published on behalf of Chemistry Europe, an association of 16 European chemical societies.
Fully comprehensive in its scope, ChemPlusChem publishes articles covering new results from at least two different aspects (subfields) of chemistry or one of chemistry and one of another scientific discipline (one chemistry topic plus another one, hence the title ChemPlusChem). All suitable submissions undergo balanced peer review by experts in the field to ensure the highest quality, originality, relevance, significance, and validity.