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Fe^II(EDTA)^2-溶液吸收NO气体的传质-反应过程 Fe^II(EDTA)^2-溶液吸收NO气体的传质-反应过程
Q3 Engineering Pub Date : 2015-01-01 DOI: 10.11943/j.issn.1006-9941.2015.03.016
王菲, 刘有智, 袁志国, 祁贵生, 焦纬洲
NO is difficult to be rapidly oxidized and absorbed in the wet oxidation method used in the treatment of the NO x exhaust gases produced in the production process of propellants and explosives, which cause the low absorption rate. To solve this problem, ferrous complex FeII(EDTA)2- (Ethylene Diamine Tetraacetic Acid, EDTA)was used as the absorbent of NO in a bubbling reactor. The effects of absorbing solution concentration and NO gas concentration on the absorption rate were investigated. The mass transfer-reaction process of NO absorption was analyzed. The theoretical model describing the NO absorption process was derived. Results show that: under experimental conditions, the absorption rate increases linearly with the increase of NO concentration, and the NO absorbed by FeII(EDTA)2- is a pseudo first-order reaction process. The error between calculated values obtained by absorption process model and experimental ones is within 5%, both have good consistency, which can be used to describe the mass transfer-reaction process of NO absorbed by FeII(EDTA)2- solution.
在处理推进剂和炸药生产过程中产生的nox废气时,采用湿式氧化法处理NO很难被快速氧化和吸收,导致吸收率低。为了解决这一问题,在鼓泡反应器中采用铁络合物FeII(EDTA)2-(乙二胺四乙酸,EDTA)作为NO的吸附剂。考察了吸收液浓度和NO气体浓度对吸收率的影响。分析了NO吸附的传质反应过程。导出了描述NO吸收过程的理论模型。结果表明:在实验条件下,FeII(EDTA)2-对NO的吸附速率随NO浓度的增加呈线性增加,且FeII(EDTA)2-对NO的吸附是一个准一级反应过程。吸附过程模型计算值与实验值误差在5%以内,具有较好的一致性,可用于描述FeII(EDTA)2-溶液吸附NO的传质反应过程。
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引用次数: 0
加速量热仪研究2,4,6-三氨基-3,5-二硝基吡啶-1-氧化物的热分解 加速量热仪研究2,4,6-三氨基-3,5-二硝基吡啶-1-氧化物的热分解
Q3 Engineering Pub Date : 2015-01-01 DOI: 10.11943/J.ISSN.1006-9941.2015.05.002
何志伟, 颜事龙, 刘祖亮, 李洪伟
为研究高能量密度材料2,4,6-三氨基-3,5-二硝基吡啶-1-氧化物(TANPyO)的热分解性能和热稳定性,利用绝热加速量热仪(ARC)测量其在绝热条件下的热分解过程,获得了热分解的温升速率、温度和压力等随时间的变化关系以及温升速率、压力随温度的变化曲线。结果表明:TANPyO绝热分解主要有两个放热过程,其中第二过程温升速率升降幅度较大,为主要的热分解过程。TANPyO初始分解温度高达252.7℃,具有良好的热稳定性。根据温升速率方程和Arrhenius公式计算出TANPyO表观活化能、指前因子和反应热分别为476.96kJ·mol-1、6.920×1042min-1和930.84J·g-1。
为研究高能量密度材料2,4,6-三氨基-3,5-二硝基吡啶-1-氧化物(TANPyO)的热分解性能和热稳定性,利用绝热加速量热仪(ARC)测量其在绝热条件下的热分解过程,获得了热分解的温升速率、温度和压力等随时间的变化关系以及温升速率、压力随温度的变化曲线。结果表明:TANPyO绝热分解主要有两个放热过程,其中第二过程温升速率升降幅度较大,为主要的热分解过程。TANPyO初始分解温度高达252.7℃,具有良好的热稳定性。根据温升速率方程和Arrhenius公式计算出TANPyO表观活化能、指前因子和反应热分别为476.96kJ·mol-1、6.920×1042min-1和930.84J·g-1。
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引用次数: 0
凝胶模板法制备RDX/B/Fe 2 O 3 纳米复合含能材料 凝胶模板法制备RDX/B/Fe 2 O 3 纳米复合含能材料
Q3 Engineering Pub Date : 2015-01-01 DOI: 10.11943/j.issn.1006-9941.2015.05.001
王瑞浩, 晋日亚, 王金英, 张景林, 王敦举
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引用次数: 0
N,N-双((3,5-二硝基-1,2,4-三唑-1-基)甲基)硝胺的合成及性能 N,N-双((3,5-二硝基-1,2,4-三唑-1-基)甲基)硝胺的合成及性能
Q3 Engineering Pub Date : 2015-01-01 DOI: 10.11943/j.issn.1006-9941.2015.12.003
李亚南, 吴敏杰, 张生勇, 刘宁, 王伯周
以3,5-二氨基-1,2,4-三唑(DAT)为原料,经重氮化、硝化、N-烷基化等反应合成了N,N-双((3,5-二硝基-1,2,4-三唑-1-基)甲基)硝胺(BDNTMN)。利用1HNMR,13CNMR、红外、质谱及元素分析等手段表征了化合物的结构。采用DSC和TG方法分析了目标化合物BDNTMN的主要热性能。采用Gaussian09程序和Kamlat—Jacbos方程预估了BDNTMN的理化性质和爆轰性能。结果表明。BDNTMN在170.4℃和254.1℃分别有两个热分解峰。预估的BDNTMN的密度、爆速和爆压分别为1.95g·cm-1、9.03km·s-1和38.7GPa,性能优于RDX。
以3,5-二氨基-1,2,4-三唑(DAT)为原料,经重氮化、硝化、N-烷基化等反应合成了N,N-双((3,5-二硝基-1,2,4-三唑-1-基)甲基)硝胺(BDNTMN)。利用1HNMR,13CNMR、红外、质谱及元素分析等手段表征了化合物的结构。采用DSC和TG方法分析了目标化合物BDNTMN的主要热性能。采用Gaussian09程序和Kamlat—Jacbos方程预估了BDNTMN的理化性质和爆轰性能。结果表明。BDNTMN在170.4℃和254.1℃分别有两个热分解峰。预估的BDNTMN的密度、爆速和爆压分别为1.95g·cm-1、9.03km·s-1和38.7GPa,性能优于RDX。
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引用次数: 0
Comparison with Molecular Surface Electrostatic Potential and Thermal Reactivity of Nitramines 硝胺分子表面静电势和热反应性的比较
Q3 Engineering Pub Date : 2015-01-01 DOI: 10.11943/J.ISSN.1006-9941.2015.12.001
S. Zeman, Z. Friedl, Monika Barto kov, Qi-Long Yan
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引用次数: 6
1-甲基-2,4,5-三硝基咪唑的晶体形貌预测 1-甲基-2,4,5-三硝基咪唑的晶体形貌预测
Q3 Engineering Pub Date : 2014-08-26 DOI: 10.11943/J.ISSN.1006-9941.2015.05.008
冯璐璐, 曹端林, 王建龙, 陈丽珍, 陈芳, 张楠, 柳沛宏
为了解1-甲基-2, 4, 5-三硝基咪唑(MTNI)晶体结构及晶体生长过程, 利用分子模拟软件Materials Studio (MS)中的BFDH、Growth Morphology和Equilibrium Morphology方法预测了MTNI在真空中的晶体形貌, 得到了形态学上重要的生长晶面。分析表明: (012)晶面是强极性面, (110)和(111)面为极性面, (010)面为弱极性面。在强极性溶剂中, (012)、(110)和(111)晶面生长受阻, 成为显露面, 而(010)面会逐渐变小, 甚至消失。在弱极性溶剂中, 晶面生长情况刚好相反。MTNI在乙醇、丙酮、乙醚、乙酸乙酯、二氯甲烷、二甲基甲酰胺(DMF)、甲醇7种溶剂中的预测晶体形貌, 与实验所得晶体晶形相吻合。当与乙醇、二氯甲烷、DMF作用后, MTNI的晶习为类球状, 球形度分别为1.12、1.11、1.12。
为了解1-甲基-2, 4, 5-三硝基咪唑(MTNI)晶体结构及晶体生长过程, 利用分子模拟软件Materials Studio (MS)中的BFDH、Growth Morphology和Equilibrium Morphology方法预测了MTNI在真空中的晶体形貌, 得到了形态学上重要的生长晶面。分析表明: (012)晶面是强极性面, (110)和(111)面为极性面, (010)面为弱极性面。在强极性溶剂中, (012)、(110)和(111)晶面生长受阻, 成为显露面, 而(010)面会逐渐变小, 甚至消失。在弱极性溶剂中, 晶面生长情况刚好相反。MTNI在乙醇、丙酮、乙醚、乙酸乙酯、二氯甲烷、二甲基甲酰胺(DMF)、甲醇7种溶剂中的预测晶体形貌, 与实验所得晶体晶形相吻合。
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引用次数: 0
A Novel Energetic Material Hydrazinium 3, 5-Dinitroamino-1, 2, 4-triazole:Synthesis and Properties 新型含能材料3,5 -二硝基氨基- 1,2,4 -三唑肼的合成及性能研究
Q3 Engineering Pub Date : 2014-08-25 DOI: 10.3969/J.ISSN.1006-9941.2014.04.027
周诚, 王伯周, 霍欢, 周群, 杨威, 叶志虎
A novel energetic material,hydrazinium 3,5-dinitroamino-1,2,4-triazole( HDN AT) was designed and synthesized for the first time via condensation,nitrification and hydrazinolysis reaction w ith a total yield of 63. 69%. It's structure w as characterized by1 H N M R,13 C N M R,FT-IR and elemental analysis. In addition,some main properties of physico-chemistry and detonation for HDN AT w ere obtained by test or calculation. R esults show that its density is 1. 89 g·cm- 3,melting point 194-196 ℃,friction sensitivity 92%,impact sensitivity 100%,H5026. 8 cm,detonation velocity 9000 m·s- 1( ρ =1.80 g·cm- 3)and detonation pressure 36. 0 GPa calculated w ith VLM method.
通过缩合、硝化和肼解反应,首次设计合成了一种新型含能材料- 3,5-二硝基氨基-1,2,4-三唑肼(HDN AT),总产率为63。69%。其结构由1h N M R、13c N M R、FT-IR和元素分析表征。此外,还通过试验和计算得到了HDN AT的一些主要理化性能和爆轰性能。R结果表明其密度为1。89 g·cm- 3,熔点194-196℃,摩擦灵敏度92%,冲击灵敏度100%,H5026。8 cm,爆速9000 m·s- 1(ρ =1.80 g·cm- 3),爆压36。用VLM法计算出的GPa。
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引用次数: 1
2-甲基-4,5-二硝基三唑-1-氧化物的合成与表征 2-甲基-4,5-二硝基三唑-1-氧化物的合成与表征
Q3 Engineering Pub Date : 2014-02-25 DOI: 10.3969/J.ISSN.1006-9941.2014.01.003
杨威, 尉涛, 王晓峰, 王伯周, 李亚南, 王友兵
以乙二醛、甲基肼和盐酸羟胺为起始原料, 经缩合、肟化, 生成的中间体不经分离直接加入硫酸铜-吡啶-水体系, 缩合环化得到2-甲基三唑-1-氧化物(MTO)。并用硝硫混酸硝化合成出2-甲基-4, 5-二硝基三唑-1-氧化物(DNMTO), 由文献报道的4步反应缩减为2步, 总收率16%, 纯度99%。对采用红外光谱、核磁、质谱以及元素分析等对MTO和DNMTO进行了结构表征。确定了缩合环化反应与硝化反应最佳反应条件为100 ℃, 反应0.5 h。在B3LYP/aug-cc-pVDZ基组水平上对DNMTO的结构进行了优化, 获得稳定的几何构型、键级, 并得出温度对热力学性能影响的关系式。结果表明:热能、热容、熵均随温度的升高而增大。
以乙二醛、甲基肼和盐酸羟胺为起始原料, 经缩合、肟化, 生成的中间体不经分离直接加入硫酸铜-吡啶-水体系, 缩合环化得到2-甲基三唑-1-氧化物(MTO)。并用硝硫混酸硝化合成出2-甲基-4, 5-二硝基三唑-1-氧化物(DNMTO), 由文献报道的4步反应缩减为2步, 总收率16%, 纯度99%。对采用红外光谱、核磁、质谱以及元素分析等对MTO和DNMTO进行了结构表征。确定了缩合环化反应与硝化反应最佳反应条件为100 ℃, 反应0.5 h。在B3LYP/aug-cc-pVDZ基组水平上对DNMTO的结构进行了优化, 获得稳定的几何构型、键级, 并得出温度对热力学性能影响的关系式。结果表明:热能、热容、熵均随温度的升高而增大。
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引用次数: 0
1,3,5-三硝基-2,3-二氢-1H-咪唑并[4,5-b]吡啶-2-酮的合成及热分解 1,3,5-三硝基-2,3-二氢-1H-咪唑并[4,5-b]吡啶-2-酮的合成及热分解
Q3 Engineering Pub Date : 2014-01-01 DOI: 10.3969/J.ISSN.1006-9941.2014.01.025
马丛明, 刘祖亮, 姚其正
以2,3-二氨基吡啶为原料,经闭环得到2,3-二氢-1H-咪唑并[4,5-b]吡啶-2-酮(1),并在HNO3/Ac2O体系中硝化,合成出1,3,5-三硝基-2,3-二氢-1H-咪唑并[4,5-b]吡啶-2-酮(2),产率为44.6%。采用核磁共振、质谱、红外对其进行了结构表征。利用差示扫描量热技术和热重分析法研究了化合物2的热性能,分解温度为153.0℃,热重变化范围为130~450℃,共失重55.5%,热稳定性差。
以2,3-二氨基吡啶为原料,经闭环得到2,3-二氢-1H-咪唑并[4,5-b]吡啶-2-酮(1),并在HNO3/Ac2O体系中硝化,合成出1,3,5-三硝基-2,3-二氢-1H-咪唑并[4,5-b]吡啶-2-酮(2),产率为44.6%。采用核磁共振、质谱、红外对其进行了结构表征。利用差示扫描量热技术和热重分析法研究了化合物2的热性能,分解温度为153.0℃,热重变化范围为130~450℃,共失重55.5%,热稳定性差。
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引用次数: 0
Characterization of the Coverage of Polymer-coated RDX 聚合物包覆RDX覆盖度的表征
Q3 Engineering Pub Date : 2014-01-01 DOI: 10.3969/J.ISSN.1006-9941.2014.01.012
Shuai Zhang, Jia Wang, Tianbo Zhao, H. Ding, Wei Jiang, Tianbo Zhao, G. Luo, Hui Huang
C oated R DX w ere prepared by w ater suspension coating method,spray coating method and demulsification method,using acrylonitrile-styrene( AS) copolymer,fluoro rubber( F2311),polyurethane elastomer( Estane5701) and w aterborne polyurethane( W PU) as coating raw materials,respectively. T he high performance liquid chromatography( HPLC) determination of coated particles,quantitative determination of the dissolution quantity of R DX and calculation of the adhesive coated degree of R DX w ere carried out. T he characterization efficacy of HPLC,scanning electron microscope( SEM) and energy dispersive spectroscopy( EDS) w as compared. R esults show that using AS as raw material,the coated particles obtained by spray coating method have dense coating and perfect physical contact w ith the surface of R DX. T he situation of incomplete coating is not detected by EDS. T he degree of coverage obtained by HPLC is 96. 24%.
以丙烯腈-苯乙烯(AS)共聚物、氟橡胶(F2311)、聚氨酯弹性体(Estane5701)和水性聚氨酯(wpu)为涂层原料,分别采用水悬浮涂覆法、喷雾涂覆法和破乳法制备了涂层R DX w。采用高效液相色谱法测定包覆颗粒,定量测定R DX的溶出量,计算R DX的粘接包覆度。比较了高效液相色谱(HPLC)、扫描电镜(SEM)和能谱(EDS)的表征效果。结果表明,以AS为原料,采用喷雾涂布法得到的涂覆颗粒包覆致密,与rdx表面物理接触良好。EDS没有检测到涂层不完全的情况。高效液相色谱法的覆盖度为96。24%。
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引用次数: 3
期刊
Hanneng Cailiao/Chinese Journal of Energetic Materials
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