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Pure carbon-number components to characterize the hydrocarbon mixture for kinetic modeling of hydrogenation process

机译:纯碳数组分表征烃混合物,用于加氢过程动力学建模

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摘要

Hydrogenation is an important processing technology for upgrading inferior oil. Kinetic modeling for hydrogenation process continues to be a challenging task because of the complex compounds and reactions involved. Therefore, a systematic carbon-number components-based substitution approach was proposed in this work as representatives of real feedstock (e.g. residual oil, vacuum gas oil, coal tar, etc). The primary advantage of the approach lies in direct availability of chemical character and physical property data. The detailed molecular compositions of components were also determined in the optimization algorithm by correlating the bulk experimental properties of original mixture. On this basis, the detailed kinetic modeling of hydrogenation process based on the real components reaction pathway could be constructed. The approach was verified using a set of 64 pure components to characterize the coal tar feedstock and used to simulate the reaction modeling of coal tar hydrogenation process. Results revealed that the hydrogenation product distribution and the chemical hydrogen consumption were predicted effectively. This work provides a significant guidance for the design and optimization of hydrogenation process. (C) 2017 Elsevier Ltd. All rights reserved.
机译:氢化是提升劣质油的重要加工技术。由于涉及复杂的化合物和反应,加氢过程的动力学建模仍然是一项艰巨的任务。因此,在这项工作中提出了一种系统的基于碳数成分的替代方法,作为真实原料(例如,渣油,减压瓦斯油,煤焦油等)的代表。该方法的主要优点在于可以直接获得化学特性和物理性质数据。通过关联原始混合物的整体实验性质,还可以在优化算法中确定组分的详细分子组成。在此基础上,可以建立基于真实组分反应路径的加氢过程详细动力学模型。该方法已使用一组64种纯组分进行了验证,以表征煤焦油原料,并用于模拟煤焦油加氢过程的反应模型。结果表明,可以有效地预测氢化产物的分布和化学耗氢量。这项工作为氢化工艺的设计和优化提供了重要指导。 (C)2017 Elsevier Ltd.保留所有权利。

著录项

  • 来源
    《Fuel》 |2017年第15期|287-295|共9页
  • 作者单位

    Chinese Acad Sci, Inst Proc Engn, Natl Key Lab Clean & Efficient Coking Technol, State Key Lab Multiphase Complex Syst,Beijing Key, Beijing 100190, Peoples R China;

    Qingdao Univ Sci Technol, Chem Ind, Hitech Inst Petr, Qingdao 266042, Shandong, Peoples R China;

    Chinese Acad Sci, Inst Proc Engn, Natl Key Lab Clean & Efficient Coking Technol, State Key Lab Multiphase Complex Syst,Beijing Key, Beijing 100190, Peoples R China;

    Chinese Acad Sci, Inst Proc Engn, Natl Key Lab Clean & Efficient Coking Technol, State Key Lab Multiphase Complex Syst,Beijing Key, Beijing 100190, Peoples R China;

    Univ Chinese Acad Sci, Sch Chem & Chem Engn, Beijing 100049, Peoples R China;

    Chinese Acad Sci, Inst Proc Engn, Natl Key Lab Clean & Efficient Coking Technol, State Key Lab Multiphase Complex Syst,Beijing Key, Beijing 100190, Peoples R China;

  • 收录信息 美国《科学引文索引》(SCI);美国《工程索引》(EI);
  • 原文格式 PDF
  • 正文语种 eng
  • 中图分类
  • 关键词

    Hydrogenation process; Kinetic modeling; Pure component; Characterization;

    机译:加氢过程;动力学模型;纯组分;表征;

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