Performance of enzymatic glucose fuel cells: a mathematical comparison of hybrid and direct electron transfer models

IF 3.1 4区 化学 Q3 ELECTROCHEMISTRY
Samuel Reji, Balaji Krishnamurthy
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引用次数: 0

Abstract

Operational parameters and electron transfer mechanisms influence the performance of enzymatic glucose fuel cells. Under various conditions, including pH, temperature, overpotential, substrate concentrations, and cell potential, the processes of Direct Electron Transfer (DET) and hybrid Direct Electron Transfer -mediated electron transfer (DET–MET) are modeled and compared through numerical modeling and analysis. The hybrid model is developed based on the competition pathways. Over the parameter ranges investigated (pH 5–9, 270–310 K, 0-0.5 M glucose), the hybrid method shows 20% greater performance than DET. MET pathways help the hybrid system exhibit a lower-activation energy route. The Hybrid model accounts for the competing reaction channels between DET and MET at the enzyme re-oxidation step. The hybrid model shows reasonable agreement with experimental data, yielding R² = 0.977 for the polarization curve and R² = 0.873 for concentration dependence. These results provide a quantitative modeling framework that can inform future designs of enzymatic glucose fuel cells (EGFCs).

酶促葡萄糖燃料电池的性能:混合和直接电子转移模型的数学比较
操作参数和电子传递机制影响酶促葡萄糖燃料电池的性能。在不同的条件下,包括pH、温度、过电位、底物浓度和细胞电位,通过数值模拟和分析,模拟和比较了直接电子转移(DET)和混合直接电子转移介导电子转移(DET - met)的过程。基于竞争路径建立了混合模型。在研究的参数范围内(pH 5-9, 270-310 K, 0-0.5 M葡萄糖),混合方法的性能比DET高20%。MET途径有助于混合体系表现出更低的活化能。混合模型解释了DET和MET在酶再氧化阶段的竞争反应通道。混合模型与实验数据吻合较好,极化曲线R²= 0.977,浓度依赖性R²= 0.873。这些结果提供了一个定量建模框架,可以为未来酶促葡萄糖燃料电池(egfc)的设计提供信息。
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来源期刊
CiteScore
4.80
自引率
4.00%
发文量
227
审稿时长
4.1 months
期刊介绍: The Journal of Solid State Electrochemistry is devoted to all aspects of solid-state chemistry and solid-state physics in electrochemistry. The Journal of Solid State Electrochemistry publishes papers on all aspects of electrochemistry of solid compounds, including experimental and theoretical, basic and applied work. It equally publishes papers on the thermodynamics and kinetics of electrochemical reactions if at least one actively participating phase is solid. Also of interest are articles on the transport of ions and electrons in solids whenever these processes are relevant to electrochemical reactions and on the use of solid-state electrochemical reactions in the analysis of solids and their surfaces. The journal covers solid-state electrochemistry and focusses on the following fields: mechanisms of solid-state electrochemical reactions, semiconductor electrochemistry, electrochemical batteries, accumulators and fuel cells, electrochemical mineral leaching, galvanic metal plating, electrochemical potential memory devices, solid-state electrochemical sensors, ion and electron transport in solid materials and polymers, electrocatalysis, photoelectrochemistry, corrosion of solid materials, solid-state electroanalysis, electrochemical machining of materials, electrochromism and electrochromic devices, new electrochemical solid-state synthesis. The Journal of Solid State Electrochemistry makes the professional in research and industry aware of this swift progress and its importance for future developments and success in the above-mentioned fields.
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