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燃料化学学报, 2020, 48(9): 1035-1046. Citation: ZHANG Xiu-xia, LÜ Xiao-xue, XIAO Mei-hua, LIN Ri-yi, ZHOU Zhi-jun. Molecular reaction dynamics simulation of pyrolysis mechanism of typical bituminous coal via ReaxFF[J]. Combustion mechanism development and CFD simulation for the prediction of soot emission during flaring: Anan Wang 1,Helen H. Lou 1 (),Daniel Chen 1,Anfeng Yu 2,Wenyi Dang 2 (),Xianchang Li 3,Christopher Martin 4,Vijaya Damodara 1,Ajit Patki 3: 1.Dan F. Smith Department of Chemical Engineering, Lamar University, Beaumont, TX 77710, USA 2.SINOPEC Safety Engineering Institute, … Abstract The flow field and reaction processes in a coal hydrogasifier reactor were modeled using a three-dimensional numerical model of Rockwell's 6 t/d entrained flow coal hydrogasifier using the hydropyrolysis kinetic model developed by Johnson and Tran as well as tar hydrocracking reactions.The numerical predictions were in good agreement with experimental results for the 6 t/d hydrogasifier.

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Amsterdam: Elsevier, 1982, 39–72: 52: X X Han, X M Jiang, Z G Cui. Studies of the effect of retorting factors on the yield of shale oil for … 引用本文: 张秀霞, 吕晓雪, 肖美华, 林日亿, 周志军. 典型烟煤热解机理的反应动力学模拟[J]. 燃料化学学报, 2020, 48(9): 1035-1046. Citation: ZHANG Xiu-xia, LÜ Xiao-xue, XIAO Mei-hua, LIN Ri-yi, ZHOU Zhi-jun. Molecular reaction dynamics simulation of pyrolysis mechanism of typical bituminous coal via ReaxFF[J].

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