[1]曾文.当量比对正庚烷预混燃烧下多环芳烃生成影响[J].深圳大学学报理工版,2012,29(No.5(377-470)):449-454.[doi:10.3724/SP.J.1249.2012.05449]
 ZENG Wen.Effect of equivalence ratio on polycyclic aromatic hydrocarbons formation in premixed n-heptane combustion[J].Journal of Shenzhen University Science and Engineering,2012,29(No.5(377-470)):449-454.[doi:10.3724/SP.J.1249.2012.05449]
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当量比对正庚烷预混燃烧下多环芳烃生成影响()
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《深圳大学学报理工版》[ISSN:1000-2618/CN:44-1401/N]

卷:
第29卷
期数:
2012年No.5(377-470)
页码:
449-454
栏目:
环境与能源
出版日期:
2012-09-21

文章信息/Info

Title:
Effect of equivalence ratio on polycyclic aromatic hydrocarbons formation in premixed n-heptane combustion
作者:
曾文
沈阳航空航天大学航空航天工程学院,沈阳 110136
Author(s):
ZENG Wen
School of Aerospace Engineering, Shenyang Aerospace University, Shenyang 110136, P.R.China
关键词:
工程热物理正庚烷多环芳烃预混燃烧数值模拟敏感性分析环境污染汽车尾气排放
Keywords:
engineering thermophysics n-heptane polycyclic aromatic hydrocarbons (PAHs) premixed combustion numerical simulation sensitivity analysis environmental pollution automobile exhaust emission
分类号:
TK 401
DOI:
10.3724/SP.J.1249.2012.05449
文献标志码:
A
摘要:
采用107种组分和542个基元反应的化学反应机理,数值模拟正庚烷预混燃烧下多环芳烃的生成.计算分析正庚烷预混燃烧下主要反应物(O2和n-C7H16)、反应生成物(CO、CO2和多环芳烃)和中间产物(CH4、C2H4和C3H6)的分布,并与测量结果进行对比.分析燃烧当量比对多环芳烃生成规律、苯与联苯生成速率及苯生成关键反应基元步敏感性的影响.结果发现,主要反应物、反应生成物及部分中间产物分布规律的计算结果与实测结果吻合,说明该机理可用于正庚烷预混燃烧下产物预测,随燃烧当量比增加,苯、联苯、菲和芘的体积分数升高,苯与联苯的总生成速率显著提高.
Abstract:
Polycyclic aromatic hydrocarbons(PAHs) formation in premixed n-heptane combustion was simulated using a detailed mechanism including 107 species and 542 elementary reactions. The species concentration distributions were analyzed numerically, with the species including the main reactants(O2 and n-C7H16), main products(CO and CO2), intermediate products(CH4, C2H4 and C3H6), and PAHs. The computational results were compared with the experiment data. The effect of combustion equivalence ratio on PAHs formation, the formation speed of benzene(A1) and naphthalene(A2), and the sensitivity to the key reaction of A1 formation were analyzed as well. The results show that the computational results for the species concentration distributions of the main reactants, main products and intermediate products agree with the experiment data. The model can be used to predict reaction products in premixed n-heptane combustion. Furthermore, with the combustion equivalence ratio increasing, the mole fractions of A1, A2, phenanthrene(A3), and pyrene(A4) are improved. The total formation speeds of A1 and A2 are also improved.

参考文献/References:

[1] WEI Jun-fei, WU Jia-qiang, JIAO Wen-juan. Toxicity of polycyclic aromatic hydrocarbons and its disposal [J]. Pollution Control Technology, 2008,21(3): 65-70.(in Chinese)
魏俊飞, 吴家强, 焦文娟. 多环芳烃的毒性及其治理技术研究[J]. 污染防治技术, 2008, 21(3): 65-70.
[2] Anna A D. Detailed kinetic modeling of particulate formation in rich premixed flames of ethylene[J]. Energy and Fuels, 2008, 22(3): 1610-1619.
[3] Lasco M, Domeno C, Nerin C. Use of lichens as pollution bio-monitors in remote areas: comparison of PAHs extracted from lichens and atmospheric particles sampled in and around the somport tunnel (pyrenees) [J]. Environment Science and Technology, 2006, 40(3): 6384-6391.
[4] Leszczuk P, Baran S. Polycyclic aromatic hydrocarbons content in shoots and leaves of willow (salix viminalis) cultinated on the sewage sludge-amended soil[J]. Water, Air and Soil Pollution, 2005, 168(1): 91-111.
[5] Guilloteau A, Bedjanian Y, Nguyen M L, et al. Desorption of polycyclic aromatic hydrocarbons from a soot surface: three to five-ring PAHs[J]. Journal of Physical Chemistry A, 2010, 114(2): 942-948.
[6] ZENG Wen, XIE Mao-zhao, MA Hong-an. Numerical simulation of polycyclic aromatic hydrocarbons formation in iso-octane HCCI combustion [J]. Journal of Shenzhen University Science and Engineering, 2010, 27(3): 354-360.(in Chinese)
曾文, 解茂昭, 马洪安. 异辛烷HCCI燃烧下多环芳烃数值模拟[J]. 深圳大学学报理工版, 2010, 27(3): 354-360.
[7] Tien T W, Hsuan M H, Ming C Y. Polycyclic aromatic hydrocarbons (PAHs) in bio-crudes from induction-heating pyrolysis of biomass wastes [J]. Bio-Resource Technology, 2007, 98(3): 1133-1137.
[8] Appel J, Bockhorn H, Frenklach M. Kinetic modeling of soot formation with detailed chemistry and physics: laminar premixed flames of C2 hydrocarbons [J]. Combustion and Flame, 2000, 121(1): 122-136.
[9] Hossam E A, Suresh M. Large eddy simulation of soot formation in a turbulent non-premixed jet flame[J]. Combustion and Flame, 2009, 156(2): 385-395.
[10] Kamphus M, Unkhoff M B, Hinghaus K K. Formation of small PAHs in laminar premixed low-pressure propene and cyclopentene flames: experiment and modeling[J]. Combustion and Flame, 2008, 152(1/2): 28-59.
[11] SONG Ya-na, GONG Jing-song, ZHONG Bei-jing. Numerical study on polycyclic aromatic hydrocarbons reduction by adding hydrogen in diesel engines[J]. Journal of Engineering Thermophysics, 2009, 30(8): 1408-1410.(in Chinese)
宋雅娜, 龚景松, 钟北京. 柴油机加氢降低多环芳烃的数值模拟[J]. 工程热物理学报, 2009, 30(8): 1408-1410.
[12] Rasmussen C L, Rasmussen A E, Glarborg P. Sensitizing effects of NOx on CH4 oxidation at high pressure [J]. Combustion and Flame, 2008, 154(3): 529-545.
[13] Kee R J, Rupley F M, Meeks E, et al. Chemkin-III: a fortran chemical kinetics package for the analysis of gasphase chemical and plasma kinetics[P]. Sandia National Laboratory Report, CA96-8216, 1996.
[14] Wang H, Frenklach M. A detailed kinetic modeling study of aromatics formation in laminar premixed acetylene and ethylene flames[J]. Combustion and Flame, 1997, 110(1/2): 173-221.
[15] Curran H J, Gaffuri P, Pitz W J, et al. A comprehensive modeling study of n-heptane oxidation[J]. Combustion and Flame, 1998, 114(1/2): 149-177.
[16] Bakali A E, Delfau J L, Vovelle C. Experimental study of 1 atmosphere, rich, premixed n-heptane and iso-octane flames[J]. Combustion Science and Technology, 1998, 140(1/2): 69-91.

相似文献/References:

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 ZENG Wen,XIE Mao-zhao,and MA Hong-an.Simulation of polycyclic and aromatic hydrocarbons formation in isooctane HCCI combustion[J].Journal of Shenzhen University Science and Engineering,2010,27(No.5(377-470)):354.
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备注/Memo

备注/Memo:
Received:2010-10-10;Revised:2011-09-26;Accepted:2012-05-26
Foundation:National Natural Science Foundation of China (50906059); Education Department Foundation of Liaoning Province (L2010418)
Corresponding author:Associate professor ZENG Wen. E-mail: zengwen928@sohu.com
Citation: ZENG Wen. Effect of equivalence ratio on polycyclic aromatic hydrocarbons formation in premixed n-heptane combustion[J]. Journal of Shenzhen University Science and Engineering, 2012, 29(5): 449-454.(in Chinese)
基金项目:国家自然科学基金资助项目(50906059);辽宁省教育厅资助项目(L2010418)
作者简介:曾文(1977-),男(汉族),湖南省沅江市人,沈阳航空航天大学副教授、博士.E-mail: zengwen928@sohu.com
引文:曾文. 当量比对正庚烷预混燃烧下多环芳烃生成影响[J]. 深圳大学学报理工版,2012, 29(5):449-454.
更新日期/Last Update: 2012-09-26