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Effect of 2,5-dimethylfuran addition on ignition delay times of n-heptane at high temperatures

Zhenhua GAO, Erjiang HU, Zhaohua XU, Geyuan YIN, Zuohua HUANG

《能源前沿（英文）》 2019年 第13卷 第3期   页码 464-473 doi: 10.1007/s11708-019-0609-z

摘要： The shock tube autoignition of 2,5-dimethylfuran (DMF)/n-heptane blends (DMF0-100%, by mole fraction) with equivalence ratios of 0.5, 1.0, and 2.0 over the temperature range of 1200–1800 K and pressures of 2.0 atm and 10.0 atm were investigated. A detailed blend chemical kinetic model resulting from the merging of validated kinetic models for the components of the fuel blends was developed. The experimental observations indicate that the ignition delay times nonlinearly increase with an increase in the DMF addition level. Chemical kinetic analysis including radical pool analysis and flux analysis were conducted to explain the DMF addition effects. The kinetic analysis shows that at lower DMF blending levels, the two fuels have negligible impacts on the consumption pathways of each other. As the DMF addition increases to relatively higher levels, the consumption path of n-heptane is significantly changed due to the competition of small radicals, which primarily leads to the nonlinear increase in the ignition delay times of DMF/n-heptane blends.

关键词： ignition delay time     shock tube     kinetic model     2     5-dimethylfuran (DMF)     n-heptane    

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Numerical study of ignition mechanism of n-heptane direct injection compression-ignition engine

Xiaoping GUO, Zhanjie WANG,

《能源前沿（英文）》 2009年 第3卷 第4期   页码 432-439 doi: 10.1007/s11708-009-0050-9

摘要： A detailed chemical dynamical mechanism of oxidation of n-heptane was implemented into kiva-3 code to study the ignition mechanism of a high-temperature, high-pressure, three-dimensional-space, transient turbulent, non-homogeneous, mono-component fuel in the engine. By testing the quantity of the heat released by the chemical reaction within the cylinder cell, the elementary reaction showing an obvious increase in the cell temperature was defined as ignition reaction and the corresponding cell as ignition position. The main pathway of the ignition reaction was studied by using the reverse deducing method. The result shows that the ignition in the engine can be divided into low-temperature ignition and high-temperature ignition, both of which follow the same rule in releasing heat, called the impulse heat releasing feature. Low-temperature ignition reaction, whose ignition reaction is c5h9o1-4=ch3cho+c3h5-a, follows the oxidation mechanism, while high-temperature ignition reaction, whose ignition reaction is c2h3o1-2=ch3co, follows the decomposition mechanism. No matter which ignition it is in, the chemical reaction that restrains the ignition reaction from lasting is the deoxidization reaction of alkylperoxy radicals.

关键词： compression-ignition engine     ignition mechanism     elementary reaction     n-heptane    

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Applicability of high dimensional model representation correlations for ignition delay times of n-heptane

Wang LIU, Jiabo ZHANG, Zhen HUANG, Dong HAN

《能源前沿（英文）》 2019年 第13卷 第2期   页码 367-376 doi: 10.1007/s11708-018-0584-9

摘要： It is difficult to predict the ignition delay times for fuels with the two-stage ignition tendency because of the existence of the nonlinear negative temperature coefficient (NTC) phenomenon at low temperature regimes. In this paper, the random sampling-high dimensional model representation (RS-HDMR) methods were employed to predict the ignition delay times of n-heptane/air mixtures, which exhibits the NTC phenomenon, over a range of initial conditions. A detailed n-heptane chemical mechanism was used to calculate the fuel ignition delay times in the adiabatic constant-pressure system, and two HDMR correlations, the global correlation and the stepwise correlations, were then constructed. Besides, the ignition delay times predicted by both types of correlations were validated against those calculated using the detailed chemical mechanism. The results showed that both correlations had a satisfactory prediction accuracy in general for the ignition delay times of the n-heptane/air mixtures and the stepwise correlations exhibited a better performance than the global correlation in each subdomain. Therefore, it is concluded that HDMR correlations are capable of predicting the ignition delay times for fuels with two-stage ignition behaviors at low-to-intermediate temperature conditions.

关键词： ignition delay     random sampling     high dimensional model representation     n-heptane     fuel kinetics    

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Effect of hierarchical ZSM-5 zeolite crystal size on diffusion and catalytic performance of n-heptane

Shuman Xu, Xiaoxiao Zhang, Dangguo Cheng, Fengqiu Chen, Xiaohong Ren

《化学科学与工程前沿（英文）》 2018年 第12卷 第4期   页码 780-789 doi: 10.1007/s11705-018-1733-8

摘要： Hierarchical ZSM-5 zeolite aggregates with different sizes of nanocrystals were synthesized using different amounts of the mesoporogen 3-aminopropyltriethoxysilane. The effect of the crystal size on the catalytic cracking of -heptane was investigated and the Thiele modulus and effectiveness factor were used to determine the reaction rate-limiting step. The crystal size affected the textual properties of the catalysts but not the acidic properties of the catalysts. The reaction rate was first order with respect to the -heptane concentration. Cracking over hierarchical zeolites with nanocrystal sizes larger than about 50 nm took place under transition-limiting conditions, whereas the reaction over hierarchical zeolites with nanocrystal sizes of 15 or 30 nm proceeded under reaction control conditions. Hierarchical ZSM-5 zeolite aggregates with smaller nanocrystals had better selectivity for light olefins which can be ascribed to the shorter diffusion path lengths and lower diffusion resistance in these catalysts. Furthermore, these catalysts had lower coking levels which can be attributed to the substantial number of mesopores which prevent the formation of coke precursors.

关键词： hierarchical ZSM-5     crystal size     catalytic cracking     Thiele modulus     effectiveness factor    

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Active fuel design—A way to manage the right fuel for HCCI engines

Zhen HUANG,Zhongzhao LI,Jianyong ZHANG,Xingcai LU,Junhua FANG,Dong HAN

《能源前沿（英文）》 2016年 第10卷 第1期   页码 14-28 doi: 10.1007/s11708-016-0399-5

摘要： Homogenous charge compression ignition (HCCI) engines feature high thermal efficiency and ultralow emissions compared to gasoline engines. However, unlike SI engines, HCCI combustion does not have a direct way to trigger the in-cylinder combustion. Therefore, gasoline HCCI combustion is facing challenges in the control of ignition and, combustion, and operational range extension. In this paper, an active fuel design concept was proposed to explore a potential pathway to optimize the HCCI engine combustion and broaden its operational range. The active fuel design concept was realized by real time control of dual-fuel (gasoline and n-heptane) port injection, with exhaust gas recirculation (EGR) rate and intake temperature adjusted. It was found that the cylinder-to-cylinder variation in HCCI combustion could be effectively reduced by the optimization in fuel injection proportion, and that the rapid transition process from SI to HCCI could be realized. The active fuel design technology could significantly increase the adaptability of HCCI combustion to increased EGR rate and reduced intake temperature. Active fuel design was shown to broaden the operational HCCI load to 9.3 bar indicated mean effective pressure (IMEP). HCCI operation was used by up to 70% of the SI mode load while reducing fuel consumption and nitrogen oxides emissions. Therefore, the active fuel design technology could manage the right fuel for clean engine combustion, and provide a potential pathway for engine fuel diversification and future engine concept.

关键词： active fuel design     HCCI     gasoline     n-heptane     engine     combustion    

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Effects of fuel combination and IVO timing on combustion and emissions of a dual-fuel HCCI combustion engine

Xin LIANG, Jianyong ZHANG, Zhongzhao LI, Jiabo ZHANG, Zhen HUANG, Dong HAN

《能源前沿（英文）》 2020年 第14卷 第4期   页码 778-789 doi: 10.1007/s11708-020-0698-8

摘要： This paper experimentally and numerically studied the effects of fuel combination and intake valve opening (IVO) timing on combustion and emissions of an n-heptane and gasoline dual-fuel homogeneous charge compression ignition (HCCI) engine. By changing the gasoline fraction (GF) from 0.1 to 0.5 and the IVO timing from –15°CA ATDC to 35°CA ATDC, the in-cylinder pressure traces, heat release behaviors, and HC and CO emissions were investigated. The results showed that both the increased GF and the retarded IVO timing delay the combustion phasing, lengthen the combustion duration, and decrease the peak heat release rate and the maximum average combustion temperature, whereas the IVO timing has a more obvious influence on combustion than GF. HC and CO emissions are decreased with reduced GF, advanced IVO timing and increased operational load.

关键词： homogeneous charge compression ignition     dual-fuel     n-heptane     gasoline     intake valve opening timing    

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Separation of

Wei Hou, Qingjun Zhang, Aiwu Zeng

《化学科学与工程前沿（英文）》 2021年 第15卷 第5期   页码 1169-1184 doi: 10.1007/s11705-020-2018-6

摘要： In this study, vapor recompression and heat integration assisted distillation arrangements with either the low or high pressure in the reflux drum are proposed to reduce and/or eliminate the application of the costly refrigerant for the separation of -heptane and isobutanol mixture. The high-pressure arrangement with vapor recompression and heat integration is the most attractive among these four intensified configurations since it can reduce total annual cost by 18.10%, CO emissions by 75.01% based on natural gas (78.78% based on heavy oil fuel), and second-law efficiency by 61.20% compared to a conventional refrigerated distillation system. Furthermore, exergy destruction in each component is calculated for the heat integration configurations and is shown in pie diagrams. The results demonstrate that the high-pressure configuration presents unique advantages in terms of thermodynamic efficiency compared to the low-pressure case. In addition, dynamic control investigation is performed for the economically efficient arrangement and good product compositions are well controlled through a dual-point temperature control strategy with almost negligible product offsets and quick process responses when addressing 20% step changes in production rate and feed composition. Note that there are no composition measurement loops in our developed control schemes.

关键词： n-heptane/isobutanol     vapor recompression     heat integration     low and/or high-pressure options    

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Development of a simplified n-heptane/methane model for high-pressure direct-injection natural

Jingrui LI, Haifeng LIU, Xinlei LIU, Ying YE, Hu WANG, Xinyan WANG, Hua ZHAO, Mingfa YAO

《能源前沿（英文）》 2021年 第15卷 第2期   页码 405-420 doi: 10.1007/s11708-021-0718-3

摘要： High-pressure direct-injection (HPDI) of natu-ral gas is one of the most promising solutions for future ship engines, in which the combustion process is mainly controlled by the chemical kinetics. However, the employment of detailed chemical models for the multi-dimensional combustion simulation is significantly expensive due to the large scale of the marine engine. In the present paper, a reduced -heptane/methane model consisting of 35-step reactions was constructed using multiple reduction approaches. Then this model was further reduced to include only 27 reactions by utilizing the HyChem (Hybrid Chemistry) method. An overall good agreement with the experimentally measured ignition delay data of both -heptane and methane for these two reduced models was achieved and reasonable predictions for the measured laminar flame speeds were obtained for the 35-step model. But the 27-step model cannot predict the laminar flame speed very well. In addition, these two reduced models were both able to reproduce the experimentally measured in-cylinder pressure and heat release rate profiles for a HPDI natural gas marine engine, the highest error of predicted combustion phase being 6.5%. However, the engine-out CO emission was over-predicted and the highest error of predicted NO emission was less than 12.9%. The predicted distributions of temperature and equivalence ratio by the 35-step and 27-step models are similar to those of the 334-step model. However, the predicted distributions of OH and CH O are significantly different from those of the 334-step model. In short, the reduced chemical kinetic models developed provide a high-efficient and dependable method to simulate the characteristics of combustion and emissions in HPDI natural gas marine engines.

关键词： high-pressure direct-injection     natural gas     chemical kinetics     combustion modelling     marine engine    

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Reduced kinetic mechanism of -heptane oxidation in modeling polycyclic aromatic hydrocarbon formation

ZHONG Beijing, XI Jun

《能源前沿（英文）》 2008年 第2卷 第3期   页码 326-332 doi: 10.1007/s11708-008-0047-9

摘要： A reduced mechanism, which could couple with the multidimensional computational fluid dynamics code for quantitative description of a reacting flow, was developed for chemical kinetic modeling of polycyclic aromatic hydrocarbon formation in an opposed-flow diffusion flame. The complete kinetic mechanism, which comprises 572 reactions and 108 species, was reduced to a simplified mechanism that includes only 83 reactions and 56 species through sensitivity analysis. The results computed via this reduced mechanism are nearly indistinguishable from those via the detailed mechanism, which demonstrate that the model based on this reduced mechanism can properly describe -heptane oxidation chemistry and quantitatively predict polycyclic aromatic hydrocarbon (such as benzene, naphthalene, phenanthrene and pyrene) formation in opposed-flow diffusion flames.

关键词： phenanthrene     multidimensional computational     sensitivity analysis     polycyclic     mechanism    

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Effect of Cu-ZSM-5 catalysts with different CuO particle size on selective catalytic oxidation of N,N-Dimethylformamide

《环境科学与工程前沿（英文）》 2022年 第16卷 第10期 doi: 10.1007/s11783-022-1557-0

摘要：

● A series of Cu-ZSM-5 catalysts were tested for DMF selective catalytic oxidation.

关键词： N     N-Dimethylformamide     Selective catalytic oxidation     Cu-ZSM-5     CuO particle size    

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Enhancing the efficiency of nitrogen removing bacterial population to a wide range of C:N ratio (1.5:1 to 14:1) for simultaneous C & N removal

《环境科学与工程前沿（英文）》 2022年 第16卷 第8期 doi: 10.1007/s11783-022-1522-y

摘要：

• Simultaneous C & N removal in Methammox occurs at wide C:N ratio.

关键词： Methanogens     Biological Nitrogen Removal (BNR)     Simultaneous     Methammox     C:N ratio    

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Effect of fly ash and slag on concrete: Properties and emission analyses

TAM, Khoa N. LE, Ana Catarina Jorge EVANGELISTA, Anthony BUTERA, Cuong N. N. TRAN, Ashraf TEARA

《工程管理前沿（英文）》 2019年 第6卷 第3期   页码 395-405 doi: 10.1007/s42524-019-0019-2

摘要： Recycled concrete is a material with the potential to create a sustainable construction industry. However, recycled concrete presents heterogeneous properties, thereby reducing its applications for some structural purposes and enhancing its application in pavements. This paper provides an insight into a solution in the deformation control for recycled concrete by adding supplementary cementitious materials fly ash and blast furnace slag. Results of this study indicated that the 50% fly ash replacement of Portland cement increased the rupture modulus of the recycled concrete. Conversely, a mixture with over 50% cement replacement by either fly ash or slag or a combination of both exhibited detrimental effect on the compressive strength, rupture modulus, and drying shrinkage. The combined analysis of environmental impacts and mechanical properties of recycled concrete demonstrated the possibility of optimizing the selection of recycled concrete because the best scenario in this study was obtained with the concrete mixture M8 (50% of fly ash+ 100% recycled coarse aggregate).

关键词： recycled aggregate     recycled concrete     fly ash and slag    

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Endemicity of H9N2 and H5N1 avian influenza viruses in poultry in China poses a serious threat to poultry

Jiao HU,Xiufan LIU

《农业科学与工程前沿（英文）》 2016年 第3卷 第1期   页码 11-24 doi: 10.15302/J-FASE-2016092

摘要： The H9N2 and H5N1 avian influenza viruses (AIVs) have been circulating in poultry in China and become endemic since 1998 and 2004, respectively. Currently, they are prevalent in poultry throughout China. This endemicity makes them actively involved in the emergence of the novel lineages of other subtypes of influenza viruses, such as the well-known viruses of the highly pathogenic avian influenza (HPAI) H5N2 and the 2013 novel H7N7, H7N9 and H10N8 subtypes, thereby threatening both the poultry industry and public health. Here, we will review briefly the prevalence and evolution, pathogenicity, transmission, and disease control of these two subtypes and also discuss the possibility of emergence of potentially virulent and highly transmissible AIVs to humans.

关键词： avian influenza virus     H9N2     H5N1     novel viruses     public health    

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CO, N, and CO/N mixed gas injection for enhanced shale gas recovery and CO geological storage

《能源前沿（英文）》 2023年 第17卷 第3期   页码 428-445 doi: 10.1007/s11708-023-0865-9

摘要： In this work, using fractured shale cores, isothermal adsorption experiments and core flooding tests were conducted to investigate the performance of injecting different gases to enhance shale gas recovery and CO2 geological storage efficiency under real reservoir conditions. The adsorption process of shale to different gases was in agreement with the extended-Langmuir model, and the adsorption capacity of CO2 was the largest, followed by CH4, and that of N2 was the smallest of the three pure gases. In addition, when the CO2 concentration in the mixed gas exceeded 50%, the adsorption capacity of the mixed gas was greater than that of CH4, and had a strong competitive adsorption effect. For the core flooding tests, pure gas injection showed that the breakthrough time of CO2 was longer than that of N2, and the CH4 recovery factor at the breakthrough time (RCH4) was also higher than that of N2. The RCH4 of CO2 gas injection was approximately 44.09%, while the RCH4 of N2 was only 31.63%. For CO2/N2 mixed gas injection, with the increase of CO2 concentration, the RCH4 increased, and the RCH4 for mixed gas CO2/N2 = 8:2 was close to that of pure CO2, about 40.24%. Moreover, the breakthrough time of N2 in mixed gas was not much different from that when pure N2 was injected, while the breakthrough time of CO2 was prolonged, which indicated that with the increase of N2 concentration in the mixed gas, the breakthrough time of CO2 could be extended. Furthermore, an abnormal surge of N2 concentration in the produced gas was observed after N2 breakthrough. In regards to CO2 storage efficiency (Sstorage-CO2), as the CO2 concentration increased, Sstorage-CO2 also increased. The Sstorage-CO2 of the pure CO2 gas injection was about 35.96%, while for mixed gas CO2/N2 = 8:2, Sstorage-CO2 was about 32.28%.

关键词： shale gas     gas injection     competitive adsorption     enhanced shale gas recovery     CO2 geological storage    

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The performance of nitrate-reducing Fe(II) oxidation processes under variable initial Fe/N ratios: The

《环境科学与工程前沿（英文）》 2021年 第15卷 第4期 doi: 10.1007/s11783-020-1366-2

摘要：

•Bacterially-mediated coupled N and Fe processes examined in incubation experiments.

关键词： Denitrification     N2O emission     Fe(II) oxidation     Fe/N ratio     Fe minerals    

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标题 作者 时间 类型 操作

Effect of 2,5-dimethylfuran addition on ignition delay times of n-heptane at high temperatures

Zhenhua GAO, Erjiang HU, Zhaohua XU, Geyuan YIN, Zuohua HUANG

期刊论文

Numerical study of ignition mechanism of n-heptane direct injection compression-ignition engine

Xiaoping GUO, Zhanjie WANG,

期刊论文

Applicability of high dimensional model representation correlations for ignition delay times of n-heptane

Wang LIU, Jiabo ZHANG, Zhen HUANG, Dong HAN

期刊论文

Effect of hierarchical ZSM-5 zeolite crystal size on diffusion and catalytic performance of n-heptane

Shuman Xu, Xiaoxiao Zhang, Dangguo Cheng, Fengqiu Chen, Xiaohong Ren

期刊论文

Active fuel design—A way to manage the right fuel for HCCI engines

Zhen HUANG,Zhongzhao LI,Jianyong ZHANG,Xingcai LU,Junhua FANG,Dong HAN

期刊论文

Effects of fuel combination and IVO timing on combustion and emissions of a dual-fuel HCCI combustion engine

Xin LIANG, Jianyong ZHANG, Zhongzhao LI, Jiabo ZHANG, Zhen HUANG, Dong HAN

期刊论文

Separation of

Wei Hou, Qingjun Zhang, Aiwu Zeng

期刊论文

Development of a simplified n-heptane/methane model for high-pressure direct-injection natural

Jingrui LI, Haifeng LIU, Xinlei LIU, Ying YE, Hu WANG, Xinyan WANG, Hua ZHAO, Mingfa YAO

期刊论文

Reduced kinetic mechanism of -heptane oxidation in modeling polycyclic aromatic hydrocarbon formation

ZHONG Beijing, XI Jun

期刊论文

Effect of Cu-ZSM-5 catalysts with different CuO particle size on selective catalytic oxidation of N,N-Dimethylformamide

期刊论文

Enhancing the efficiency of nitrogen removing bacterial population to a wide range of C:N ratio (1.5:1 to 14:1) for simultaneous C & N removal

期刊论文

Effect of fly ash and slag on concrete: Properties and emission analyses

TAM, Khoa N. LE, Ana Catarina Jorge EVANGELISTA, Anthony BUTERA, Cuong N. N. TRAN, Ashraf TEARA

期刊论文

Endemicity of H9N2 and H5N1 avian influenza viruses in poultry in China poses a serious threat to poultry

Jiao HU,Xiufan LIU

期刊论文

CO, N, and CO/N mixed gas injection for enhanced shale gas recovery and CO geological storage

期刊论文

The performance of nitrate-reducing Fe(II) oxidation processes under variable initial Fe/N ratios: The

期刊论文