首页|HIx溶液的密度计算模型

HIx溶液的密度计算模型

扫码查看
氢是最佳能源载体之一,硫-碘(S-I)循环作为极具潜力的热化学循环制氢技术而被广泛关注。HI-H2O-I2(HIx)溶液是S-I循环核心环节Bunsen反应中的主要流体形态。不同温度组分下HIx溶液的密度数据对Bunsen反应器设计、液相分离过程分析等具有重要意义。本文综合分析了已发表的HIx溶液密度数据,基于比体积与活度系数关系,分别采用ELECNRTL模型和Wilson模型建立了理论密度模型。此外,基于热膨胀率建立了半经验密度模型。结果表明,采用ELECNRTL模型建立的理论密度模型的平均相对偏差(ARD)为6。95%,在模型中未考虑短程作用带来的影响,说明在HIx溶液中短程作用不可忽略;采用Wilson模型建立的理论密度模型的ARD为1。21%,在低HI和低I2浓度条件下具有较高的预测精度;采用基于热膨胀率拟合密度的半经验密度模型具有最高的计算精度,在假设热膨胀率与比体积具有二次关系时,A RD为0。93%。
The Density Model of HIx Solution
Hydrogen is considered one of the most optimum energy carriers,and the sulfur-iodine(S-I)cycle is widely regarded as a promising thermochemical approach for producing hydrogen.HI-H2O-12(HIx)solution is the major fluid medium in the Bunsen reaction,which is the core and essential part of the S-I cycle.For the design of Bunsen reactor and analysis of the liquid-liquid separation,HIx solution density data in different temperature and composition is significant.This work comprehensively analyzed the published density data of HIx solution.The ELECNRTL and Wilson models were used to develop the theoretical density model by considering the relationship between specific volume and activity coefficient.Additionally,the semi-empirical density model was developed based on the thermal expansion rate.The results showed that the average relative deviation(ARD)of the theoretical density model derived from ELECNRTL model is 6.95%,and this density model did not account for short-range interactions,suggesting that these interactions in the HIx solution are significant and should not be overlooked.The ARD of the theoretical density model derived from the Wilson model is 1.21%,showing high prediction accuracy at low HI and I2 concentrations.The semi-empirical density model,which assumed a quadratic relationship between thermal expansion rate and specific volume,achieved the highest calculation accuracy with an ARD of 0.93%.

Bunsen reactionHIx solutiondensity model

曾景昕、李肖飞、孙雪、杨震、段远源、宋蔷

展开 >

清华大学热科学与动力工程教育部重点实验室,二氧化碳资源化利用与减排技术北京市重点实验室,北京 100084

Bunsen反应 HIx溶液体系 密度模型

国家自然科学基金北京市自然科学基金项目

519761033222031

2024

工程热物理学报
中国工程热物理学会 中国科学院工程热物理研究所

工程热物理学报

CSTPCD北大核心
影响因子:0.4
ISSN:0253-231X
年,卷(期):2024.45(10)