Product characteristics of supercritical water gasification via the preheating of hydrothermal flames: A detailed chemical kinetic simulation

IF 6.7 1区 工程技术 Q2 ENERGY & FUELS
Fuel Pub Date : 2025-06-04 DOI:10.1016/j.fuel.2025.135875
Yuejie Zhao , Fengming Zhang , Yunyun Liu , Weiqing Rong , Yilin Yuan
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引用次数: 0

Abstract

A detailed chemical kinetic model was developed for supercritical water gasification (SCWG) of methanol via the preheating of hydrothermal flames, and simulated with Chemkin. The simulation model is validated by comparisons with experimental COD removal efficiencies and gas ratios. The SCWG reaction can be divided into three stages. At the first stage, methanol mainly undergoes the steam reforming reaction to produce H2 and CO. The water gas shift reaction that peaks H2 yield is the dominant chemical reaction at the second stage. At the third stage, the methanation reaction becomes active and consumes H2. The carbon dioxide promotes the methanation reaction at the third stage. The oxygen content accelerates the methanol decomposition and hydrogen formation at the beginning of the first stage, but results in lower peak values of H2 yield. The hot water and the direct preheating have the highest and lowest peaks for H2 yield, and higher peak values of H2 yield are present at higher ratios of fuel to feed flow via the preheating of hydrothermal flames. The peak of H2 yield under the preheating of hydrothermal flames is not sensitive to the reaction temperature, but higher heating values can be obtained at higher reaction temperatures.
热液火焰预热超临界水气化的产物特性:详细的化学动力学模拟
建立了热液火焰预热甲醇超临界水气化(SCWG)的详细化学动力学模型,并用Chemkin软件进行了模拟。通过与实验COD去除率和气相比的比较,验证了仿真模型的有效性。SCWG反应可分为三个阶段。在第一阶段,甲醇主要进行蒸汽重整反应生成H2和CO,第二阶段以H2产率最高的水煤气变换反应为主。在第三阶段,甲烷化反应变得活跃并消耗H2。在第三阶段,二氧化碳促进了甲烷化反应。氧含量在第一阶段初期加速了甲醇的分解和氢气的生成,但导致H2产率的峰值降低。热水和直接预热对H2产率有最高和最低的峰值,且通过热液火焰预热的燃料与料流比越高,H2产率峰值越高。热液火焰预热下的H2产率峰值对反应温度不敏感,但反应温度越高,H2产率越高。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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来源期刊
Fuel
Fuel 工程技术-工程:化工
CiteScore
12.80
自引率
20.30%
发文量
3506
审稿时长
64 days
期刊介绍: The exploration of energy sources remains a critical matter of study. For the past nine decades, fuel has consistently held the forefront in primary research efforts within the field of energy science. This area of investigation encompasses a wide range of subjects, with a particular emphasis on emerging concerns like environmental factors and pollution.
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