用于钒氧化还原液流电池的氧化石墨烯和 MXene 混合纳米流体的热电流变特性:带有超参数优化的可解释集合机器学习的应用

IF 5.9 3区 材料科学 Q2 CHEMISTRY, PHYSICAL FlatChem Pub Date : 2024-01-01 DOI:10.1016/j.flatc.2023.100606
Praveen Kumar K , K. Deepthi Jayan , Prabhakar Sharma , Mansoor Alruqi
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引用次数: 0

摘要

由于氧化石墨烯(GO)和 MXene 等二维材料具有引人入胜的特性,近期的研究广泛关注这些材料,极大地推动了纳米技术和材料研究的发展。本实验研究探讨了如何使用由 GO 和 MXene(90:10)组成的基于钒电解质的混合纳米流体(HNF)来增强钒氧化还原液流电池(VRFB)。研究人员采用多种技术合成了 GO 和 Mxene 纳米粒子(NPs),并对其进行了表征。以不同重量浓度生产的 HNF 在 10-45 °C 的温度范围内进行了稳定性、流变性、热导率 (TC) 和电导率 (EC) 分析。结果表明,HNF 在指定温度范围内表现出良好的稳定性和牛顿特性。与钒电解质相比,在 45 ℃ 时,0.1 wt% 的 HNF 可最大提高导电率(EC)20.5% 和电导率(TC)6.81%。随后,使用基于 LSBoost 的可解释集合机器学习方法开发了一个预报模型,该方法采用了一个测试数据集,并应用 5 倍交叉验证以防止过度拟合。使用贝叶斯技术实现了超参数优化。为 TC、EC 和粘度(VST)创建的基于 LSBoost 的预后模型显示出很高的有效性,R2 值分别为 0.9981、0.99 和 0.9954。预测误差极小,TC、EC 和 VST 模型的 RMSE 值分别为 0.00089255、5.553 和 0.09391。同样,MAE 值也很低,分别为 0.00068948、4.0919 和 0.06129。
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Thermo-electro-rheological properties of graphene oxide and MXene hybrid nanofluid for vanadium redox flow battery: Application of explainable ensemble machine learning with hyperparameter optimization

Recent research has extensively focused on 2D materials such as graphene oxide (GO) and MXene due to their intriguing properties, significantly advancing nanotechnology and materials research. This experimental study explores the use of a vanadium electrolyte-based hybrid nanofluid (HNF) composed of GO and MXene (90:10) to enhance vanadium redox flow batteries (VRFBs). The synthesis and characterization of GO and Mxene nanoparticles (NPs) were conducted using various techniques. The HNF, produced at different weight concentrations, underwent analysis for stability, rheology, thermal conductivity (TC), and electrical conductivity (EC) within a temperature range of 10–45 °C. The results indicate that the HNF exhibits favorable stability and Newtonian behavior in the specified temperature range. At 45 °C, the HNF achieves a maximum enhancement of 20.5 % in EC and 6.81 % in TC for 0.1 wt% compared to the vanadium electrolyte. Subsequently, a prognostic model was developed using an explainable ensemble LSBoost-based machine learning approach, employing a test dataset and applying 5-fold cross-validation to prevent overfitting. Hyperparameter optimization was achieved using the Bayesian technique. The LSBoost-based prognostic models created for TC, EC, and viscosity (VST) demonstrated high effectiveness, with R2 values of 0.9981, 0.99, and 0.9954, respectively. The prediction errors were minimal, with RMSE values of 0.00089255, 5.553, and 0.09391 for the TC, EC, and VST models, respectively. Similarly, the MAE values were low, at 0.00068948, 4.0919, and 0.06129.

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来源期刊
FlatChem
FlatChem Multiple-
CiteScore
8.40
自引率
6.50%
发文量
104
审稿时长
26 days
期刊介绍: FlatChem - Chemistry of Flat Materials, a new voice in the community, publishes original and significant, cutting-edge research related to the chemistry of graphene and related 2D & layered materials. The overall aim of the journal is to combine the chemistry and applications of these materials, where the submission of communications, full papers, and concepts should contain chemistry in a materials context, which can be both experimental and/or theoretical. In addition to original research articles, FlatChem also offers reviews, minireviews, highlights and perspectives on the future of this research area with the scientific leaders in fields related to Flat Materials. Topics of interest include, but are not limited to, the following: -Design, synthesis, applications and investigation of graphene, graphene related materials and other 2D & layered materials (for example Silicene, Germanene, Phosphorene, MXenes, Boron nitride, Transition metal dichalcogenides) -Characterization of these materials using all forms of spectroscopy and microscopy techniques -Chemical modification or functionalization and dispersion of these materials, as well as interactions with other materials -Exploring the surface chemistry of these materials for applications in: Sensors or detectors in electrochemical/Lab on a Chip devices, Composite materials, Membranes, Environment technology, Catalysis for energy storage and conversion (for example fuel cells, supercapacitors, batteries, hydrogen storage), Biomedical technology (drug delivery, biosensing, bioimaging)
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