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FUEL-NITROGEN EVOLUTION DURING FLUIDIZED BED OXY-COAL COMBUSTION

机译:流化床氧煤燃烧过程中的燃料-氮逸出

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FTIR, thermo-gravimetric analysis techniques and molecular modelling were employed to study the effect of CO2 on fuel-nitrogen evolution under oxy-combustion conditions. The main objective is to compare NOx emissions at several molar fractions of O2 using Ar or CO2 as balance gas in a fluidized bed reactor. A char with about 16% N content was prepared by pyrolysis of polyacrylonitrile. This sample facilitated NOx evolution experiments due to the abundance of nitrogen complexes, and aided the identification and quantification of several N species by means of FTIR. Results indicate that the presence of CO2 enhances NO2 formation. A complementary study was carried out by molecular modelling of the experimental reactions using the Gaussian 03 package. Different heterogeneous and homogeneous interactions between CO2 and char N-species were simulated. The results thus obtained show that the presence of CO2 during combustion can facilitate NCO formation which is a very reactive intermediate species that can be readily oxidized in the gaseous phase.
机译:FTIR,热重分析技术和分子模型被用来研究在氧气燃烧条件下二氧化碳对燃料氮释放的影响。主要目的是在流化床反应器中使用Ar或CO2作为平衡气比较O2在几个摩尔分数下的NOx排放。通过聚丙烯腈的热解制备具有约16%N含量的炭。该样品由于氮络合物的丰度而促进了NOx的释放实验,并通过FTIR协助了几种N物种的鉴定和定量。结果表明,CO2的存在会增强NO2的形成。使用高斯03程序包通过对实验反应进行分子建模来进行补充研究。模拟了CO2和char N物种之间不同的异质和均质相互作用。如此获得的结果表明,燃烧期间CO 2的存在可以促进NCO的形成,NCO是一种非常活泼的中间物种,可以在气相中容易被氧化。

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