SiC材料有限速率表面催化模型研究

Finite Rate Surface Catalysis Modelling On SiC Materials

  • 摘要: 针对SiC材料在空气高温非平衡离解气流中的表面催化模拟,在经典的吸附、解附、E-R(Eley-Rideal)和L-H(Langmuir-Hinshelwood)反应机制下,发展了一种有限速率表面催化反应模型。给出了吸附、解附、E-R和L-H等4种表面催化过程的异相有限速率表面反应模拟框架,及其在非平衡化学反应流动求解器中的实现方法。对反应参数进行敏感性分析,讨论了模型参数对表面催化反应的影响特性,进而采用近似分析方法获得不同主导反应条件下的表面催化复合系数表达式,为反应参数的试验数据标定建立了理论分析基础。根据不同壁温段的表面催化复合系数表达式形式,分别采用理论分析、线性回归及优化方法对表面催化反应模型参数进行标定,并开展模型的初步确认。结果显示:建立的表面催化反应模型与试验数据在不同压力、壁温范围符合较好, 准确预测OREX驻点峰值热流,且沿弹道驻点热流预测值与飞行试验数据整体符合较好。最后,采用新模型计算了FIRE II外形有限催化热流,并与非催化、完全催化结果进行了对比。

     

    Abstract: A finite-rate surface catalytic reaction model was developed for surface catalytic simulation of SiC materials in high-temperature nonequilibrium dissociated air flows. A heterogeneous finite-rate surface reaction simulation framework was established for four surface catalytic processes—adsorption, desorption, E-R (Eley-Rideal), and L-H (Langmuir-Hinshelwood) reaction mechanisms—and their implementation in a nonequilibrium chemical reaction flow solver was described. Sensitivity analyses were conducted on the reaction parameters to discuss the influence of model parameters on the surface catalytic reactions. Using approximate analytical methods, expressions for surface catalytic recombination coefficients under different dominant reaction conditions were derived, providing a theoretical foundation for experimental data calibration of reaction parameters. Based on the forms of surface catalytic recombination coefficient expressions in different temperature ranges, theoretical analysis, linear regression, and optimization methods were applied to calibrate the parameters of the surface catalytic reaction model, and preliminary validation of the model was carried out. The results show that the established surface catalytic reaction model agrees well with experimental data across different pressure and wall temperature ranges, accurately predicts the OREX stagnation peak heat flux, and the stagnation heat flux predictions along the trajectory are generally in good agreement with flight test data. Finally, the new model was used to calculate the finite catalytic heat flux for the FIRE II configuration, and the results were compared with non-catalytic and fully catalytic scenarios.

     

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