使用机器学习算法和RSM优化CO2吸收到MDEA-PZ-sulfolane混合溶液中
Abolfazl Shokri1, Sepehr Aarabi Dahej2, Ahad Ghaemi3
1School of Chemical, Petroleum and Gas Engineering, Iran University of Science and Technology, Tehran, Iran.
Environmental science and pollution research international
|April 14, 2025
概括
机器学习模型准确地预测混合氨基溶液中的二氧化碳 (CO2) 吸收,优于传统方法. 使用遗传算法的优化确定了最大化二氧化碳负载的关键参数.
科学领域:
- 化学工程是化学工程的重要组成部分.
- 计算化学计算化学
- 环境科学 环境科学
背景情况:
- 二氧化碳 (CO2) 吸收对于减轻温室气体排放至关重要.
- 混合氨基溶液在二氧化碳捕获方面比单溶剂具有协同效应的优势.
- 精确的建模对于优化二氧化碳吸收过程至关重要.
研究的目的:
- 为了建模和模拟混合氨基溶液中的二氧化碳吸收.
- 为了比较各种机器学习算法和响应表面方法 (RSM) 的预测准确度.
- 使用遗传算法 (GA) 来优化二氧化碳吸收.
主要方法:
- 使用了七个机器学习模型:MLP,RBF,LightGBM,XGBoost,随机森林,ExtraTrees和Adaboost.
- 使用响应表面方法 (RSM) 进行比较分析.
- 应用了基因算法 (GA) 进行参数优化.
主要成果:
- MLP和RBF模型实现了高R2值 (分别为0.9982和0.9975),显示出优异的预测性能.
- 与RSM相比,神经网络显示出更好的准确性和概括性.
- 二氧化碳吸收量随着压力和时间的增加而增加,但随着温度和溶剂度的下降而减少.
结论:
- 机器学习,特别是MLP和RBF,为混合氨基系统中二氧化碳吸收提供了非常准确的预测.
- 该研究确定了通过GA驱动的优化来最大限度地提高二氧化碳负载的最佳运行条件.
- 这些发现支持使用先进的计算方法来设计高效的二氧化碳捕获技术.
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