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CFD Simulation of Propane Cracking Tube Using Detailed Radical Kinetic Mechanism 被引量:7

CFD Simulation of Propane Cracking Tube Using Detailed Radical Kinetic Mechanism
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摘要 In the radiant section of cracking furnace,the thermal cracking process is highly coupled with turbulent flow,heat transfer and mass transfer.In this paper,a three-dimensional simulation of propane pyrolysis reactor tube is performed based on a detailed kinetic radical cracking scheme,combined with a comprehensive rigorous computational fluid dynamics(CFD)model.The eddy-dissipation-concept(EDC)model is introduced to deal with turbulence-chemistry interaction of cracking gas,especially for the multi-step radical kinetics.Considering the high aspect ratio and severe gradient phenomenon,numerical strategies such as grid resolution and refinement,stepping method and relaxation technique at different levels are employed to accelerate convergence.Large scale of radial nonuniformity in the vicinity of the tube wall is investigated.Spatial distributions of each radical reaction rate are first studied,and made it possible to identify the dominant elementary reactions.Additionally,a series of operating conditions including the feedstock feed rate,wall temperature profile and heat flux profile towards the reactor tubes are investigated.The obtained results can be used as scientific guide for further technical retrofit and operation optimization aiming at high conversion and selectivity of pyrolysis process. In the radiant section of cracking furnace, the thermal cracking process is highly coupled with turbulent flow, heat transfer and mass transfer. In this paper, a three-dimensional simulation of propane pyrolysis reactor tube is performed based on a detailed kinetic radical cracking scheme, combined with a comprehensive rigorous computational fluid dynamics(CFD) model. The eddy-dissipation-concept(EDC) model is introduced to deal with turbulence-chemistry interaction of cracking gas, especially for the multi-step radical kinetics. Considering the high aspect ratio and severe gradient phenomenon, numerical strategies such as grid resolution and refinement, stepping method and relaxation technique at different levels are employed to accelerate convergence. Large scale of radial nonuniformity in the vicinity of the tube wall is investigated. Spatial distributions of each radical reaction rate are first studied, and made it possible to identify the dominant elementary reactions. Additionally, a series of operating conditions including the feedstock feed rate, wall temperature profile and heat flux profile towards the reactor tubes are investigated. The obtained results can be used as scientific guide for further technical retrofit and operation optimization aiming at high conversion and selectivity of pyrolysis process.
出处 《Chinese Journal of Chemical Engineering》 SCIE EI CAS CSCD 2013年第12期1319-1331,共13页 中国化学工程学报(英文版)
基金 Supported by the National Science&Technology Supporting Plan(2012BAF05B00) the National Basic Research Program(2012CB720500)
关键词 numerical simulation cracking tube computational fluid dynamics(CFD) detailed radical kinetics 动力学机制 CFD模拟 热裂化 丙烷 计算流体动力学 裂解反应器 湍流流动 技术改造
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