Gas-liquid reactive crystallization kinetics of 2,4,6-triamino-1,3,5-trinitrobenzene in the semi-batch procedure
•The global gas-liquid reaction kinetics of TATB is developed.•A decrease in concentration of TCTNB is advantageous to TATB crystal growth.•The reactive crystallization kinetics of TATB is studied in the semi-batch system.•With the increasing of ammonia feeding rate, nucleation rate strongly increas...
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Veröffentlicht in: | Journal of crystal growth 2018-06, Vol.491, p.6-15 |
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description | •The global gas-liquid reaction kinetics of TATB is developed.•A decrease in concentration of TCTNB is advantageous to TATB crystal growth.•The reactive crystallization kinetics of TATB is studied in the semi-batch system.•With the increasing of ammonia feeding rate, nucleation rate strongly increases.
2,4,6-Triamino-1,3,5-trinitrobenzene is the attractive insensitive high energetic material used extensively in the military and civil fields. Combined with the double-films theory, the global gas-liquid chemical reaction kinetics of 2,4,6-triamino-1,3,5-trinitrobenzene was developed by means of the infinitesimal material balance calculation. The raw material concentration and reactive temperature effects on the crystallization of 2,4,6-triamino-1,3,5-trinitrobenzene were investigated by the batch experiments. The reactive crystallization kinetics associated ammonia feeding rate of 2,4,6-triamino-1,3,5-trinitrobenzene, including nucleation as well as crystal growth, was systematically investigated in the heterogonous semi-batch procedure. The nucleation and crystal growth kinetic exponents were estimated by the linear least-squares method. The crystallization kinetic results indicated that nucleation rate strongly increased but liner growth rate decreased with the increasing of ammonia feeding rate. In terms of manufacturing coarse 2,4,6-triamino-1,3,5-trinitrobenzene, it was found that a slow ammonia feeding rate and a low raw material concentration were feasible under the present experimental conditions. |
doi_str_mv | 10.1016/j.jcrysgro.2018.03.006 |
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2,4,6-Triamino-1,3,5-trinitrobenzene is the attractive insensitive high energetic material used extensively in the military and civil fields. Combined with the double-films theory, the global gas-liquid chemical reaction kinetics of 2,4,6-triamino-1,3,5-trinitrobenzene was developed by means of the infinitesimal material balance calculation. The raw material concentration and reactive temperature effects on the crystallization of 2,4,6-triamino-1,3,5-trinitrobenzene were investigated by the batch experiments. The reactive crystallization kinetics associated ammonia feeding rate of 2,4,6-triamino-1,3,5-trinitrobenzene, including nucleation as well as crystal growth, was systematically investigated in the heterogonous semi-batch procedure. The nucleation and crystal growth kinetic exponents were estimated by the linear least-squares method. The crystallization kinetic results indicated that nucleation rate strongly increased but liner growth rate decreased with the increasing of ammonia feeding rate. In terms of manufacturing coarse 2,4,6-triamino-1,3,5-trinitrobenzene, it was found that a slow ammonia feeding rate and a low raw material concentration were feasible under the present experimental conditions.</description><identifier>ISSN: 0022-0248</identifier><identifier>EISSN: 1873-5002</identifier><identifier>DOI: 10.1016/j.jcrysgro.2018.03.006</identifier><language>eng</language><publisher>Amsterdam: Elsevier B.V</publisher><subject>A1. Growth kinetics ; A1. Insensitive energetic materials ; A1. Nucleation ; A1. Reactive crystallization ; A2. Semi-batch process ; Ammonia ; B1. 2,4,6-Triamino-1,3,5-trinitrobenzene ; Chemical reactions ; Crystal growth ; Crystallization ; Energetic materials ; Feeding ; Fluids ; Gases ; High energy physics ; Hydrocarbons ; Kinetics ; Least squares method ; Material balance ; Nucleation ; Organic chemistry ; Reaction kinetics ; Temperature effects</subject><ispartof>Journal of crystal growth, 2018-06, Vol.491, p.6-15</ispartof><rights>2018 Elsevier B.V.</rights><rights>Copyright Elsevier BV Jun 1, 2018</rights><lds50>peer_reviewed</lds50><woscitedreferencessubscribed>false</woscitedreferencessubscribed><citedby>FETCH-LOGICAL-c377t-5ea0892863e3808e57843e9b5f37e4ac6f92a4e8480bb9a96b818a7dee89fda63</citedby><cites>FETCH-LOGICAL-c377t-5ea0892863e3808e57843e9b5f37e4ac6f92a4e8480bb9a96b818a7dee89fda63</cites></display><links><openurl>$$Topenurl_article</openurl><openurlfulltext>$$Topenurlfull_article</openurlfulltext><thumbnail>$$Tsyndetics_thumb_exl</thumbnail><linktohtml>$$Uhttps://dx.doi.org/10.1016/j.jcrysgro.2018.03.006$$EHTML$$P50$$Gelsevier$$H</linktohtml><link.rule.ids>315,781,785,3551,27928,27929,45999</link.rule.ids></links><search><creatorcontrib>Liu, Ruqin</creatorcontrib><creatorcontrib>Huang, Ming</creatorcontrib><creatorcontrib>Yao, Xiaolu</creatorcontrib><creatorcontrib>Chen, Shuang</creatorcontrib><creatorcontrib>Wang, Shucun</creatorcontrib><creatorcontrib>Suo, Zhirong</creatorcontrib><title>Gas-liquid reactive crystallization kinetics of 2,4,6-triamino-1,3,5-trinitrobenzene in the semi-batch procedure</title><title>Journal of crystal growth</title><description>•The global gas-liquid reaction kinetics of TATB is developed.•A decrease in concentration of TCTNB is advantageous to TATB crystal growth.•The reactive crystallization kinetics of TATB is studied in the semi-batch system.•With the increasing of ammonia feeding rate, nucleation rate strongly increases.
2,4,6-Triamino-1,3,5-trinitrobenzene is the attractive insensitive high energetic material used extensively in the military and civil fields. Combined with the double-films theory, the global gas-liquid chemical reaction kinetics of 2,4,6-triamino-1,3,5-trinitrobenzene was developed by means of the infinitesimal material balance calculation. The raw material concentration and reactive temperature effects on the crystallization of 2,4,6-triamino-1,3,5-trinitrobenzene were investigated by the batch experiments. The reactive crystallization kinetics associated ammonia feeding rate of 2,4,6-triamino-1,3,5-trinitrobenzene, including nucleation as well as crystal growth, was systematically investigated in the heterogonous semi-batch procedure. The nucleation and crystal growth kinetic exponents were estimated by the linear least-squares method. The crystallization kinetic results indicated that nucleation rate strongly increased but liner growth rate decreased with the increasing of ammonia feeding rate. In terms of manufacturing coarse 2,4,6-triamino-1,3,5-trinitrobenzene, it was found that a slow ammonia feeding rate and a low raw material concentration were feasible under the present experimental conditions.</description><subject>A1. Growth kinetics</subject><subject>A1. Insensitive energetic materials</subject><subject>A1. Nucleation</subject><subject>A1. Reactive crystallization</subject><subject>A2. Semi-batch process</subject><subject>Ammonia</subject><subject>B1. 2,4,6-Triamino-1,3,5-trinitrobenzene</subject><subject>Chemical reactions</subject><subject>Crystal growth</subject><subject>Crystallization</subject><subject>Energetic materials</subject><subject>Feeding</subject><subject>Fluids</subject><subject>Gases</subject><subject>High energy physics</subject><subject>Hydrocarbons</subject><subject>Kinetics</subject><subject>Least squares method</subject><subject>Material balance</subject><subject>Nucleation</subject><subject>Organic chemistry</subject><subject>Reaction kinetics</subject><subject>Temperature effects</subject><issn>0022-0248</issn><issn>1873-5002</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2018</creationdate><recordtype>article</recordtype><recordid>eNqFkM1qHDEQhEVIIBvHrxAEua4mLWl-NLcEE9sBQy7JWWg0PXZPdqW1pDXYT28tm5xz6aahqpr6GPskoZEg-y9rs_r0nO9TbBRI04BuAPo3bCPNoEUHoN6yTZ1KgGrNe_Yh5xWgOiVs2OHGZbGjxyPNPKHzhZ6Qn-KK2-3oxRWKgf-hgIV85nHhattue1ESuT2FKORWb7vTGaikOGF4wYCcAi8PyDPuSUyu-Ad-SNHjfEz4kb1b3C7j5d99wX5ff_91dSvuft78uPp2J7wehiI6dGBGZXqN2oDBbjCtxnHqFj1g63y_jMq1aFoD0zS6sZ-MNG6YEc24zK7XF-zzObd-fjxiLnaNxxTqS6tgkFoCGFVV_VnlU8w54WIPifYuPVsJ9kTXrvYfXXuia0HbSrcav56NWDs8ESabPWGoHSmhL3aO9L-IVx3-h38</recordid><startdate>20180601</startdate><enddate>20180601</enddate><creator>Liu, Ruqin</creator><creator>Huang, Ming</creator><creator>Yao, Xiaolu</creator><creator>Chen, Shuang</creator><creator>Wang, Shucun</creator><creator>Suo, Zhirong</creator><general>Elsevier B.V</general><general>Elsevier BV</general><scope>AAYXX</scope><scope>CITATION</scope><scope>7SR</scope><scope>7U5</scope><scope>8BQ</scope><scope>8FD</scope><scope>JG9</scope><scope>L7M</scope></search><sort><creationdate>20180601</creationdate><title>Gas-liquid reactive crystallization kinetics of 2,4,6-triamino-1,3,5-trinitrobenzene in the semi-batch procedure</title><author>Liu, Ruqin ; Huang, Ming ; Yao, Xiaolu ; Chen, Shuang ; Wang, Shucun ; Suo, Zhirong</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c377t-5ea0892863e3808e57843e9b5f37e4ac6f92a4e8480bb9a96b818a7dee89fda63</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2018</creationdate><topic>A1. Growth kinetics</topic><topic>A1. Insensitive energetic materials</topic><topic>A1. Nucleation</topic><topic>A1. Reactive crystallization</topic><topic>A2. Semi-batch process</topic><topic>Ammonia</topic><topic>B1. 2,4,6-Triamino-1,3,5-trinitrobenzene</topic><topic>Chemical reactions</topic><topic>Crystal growth</topic><topic>Crystallization</topic><topic>Energetic materials</topic><topic>Feeding</topic><topic>Fluids</topic><topic>Gases</topic><topic>High energy physics</topic><topic>Hydrocarbons</topic><topic>Kinetics</topic><topic>Least squares method</topic><topic>Material balance</topic><topic>Nucleation</topic><topic>Organic chemistry</topic><topic>Reaction kinetics</topic><topic>Temperature effects</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Liu, Ruqin</creatorcontrib><creatorcontrib>Huang, Ming</creatorcontrib><creatorcontrib>Yao, Xiaolu</creatorcontrib><creatorcontrib>Chen, Shuang</creatorcontrib><creatorcontrib>Wang, Shucun</creatorcontrib><creatorcontrib>Suo, Zhirong</creatorcontrib><collection>CrossRef</collection><collection>Engineered Materials Abstracts</collection><collection>Solid State and Superconductivity Abstracts</collection><collection>METADEX</collection><collection>Technology Research Database</collection><collection>Materials Research Database</collection><collection>Advanced Technologies Database with Aerospace</collection><jtitle>Journal of crystal growth</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Liu, Ruqin</au><au>Huang, Ming</au><au>Yao, Xiaolu</au><au>Chen, Shuang</au><au>Wang, Shucun</au><au>Suo, Zhirong</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Gas-liquid reactive crystallization kinetics of 2,4,6-triamino-1,3,5-trinitrobenzene in the semi-batch procedure</atitle><jtitle>Journal of crystal growth</jtitle><date>2018-06-01</date><risdate>2018</risdate><volume>491</volume><spage>6</spage><epage>15</epage><pages>6-15</pages><issn>0022-0248</issn><eissn>1873-5002</eissn><abstract>•The global gas-liquid reaction kinetics of TATB is developed.•A decrease in concentration of TCTNB is advantageous to TATB crystal growth.•The reactive crystallization kinetics of TATB is studied in the semi-batch system.•With the increasing of ammonia feeding rate, nucleation rate strongly increases.
2,4,6-Triamino-1,3,5-trinitrobenzene is the attractive insensitive high energetic material used extensively in the military and civil fields. Combined with the double-films theory, the global gas-liquid chemical reaction kinetics of 2,4,6-triamino-1,3,5-trinitrobenzene was developed by means of the infinitesimal material balance calculation. The raw material concentration and reactive temperature effects on the crystallization of 2,4,6-triamino-1,3,5-trinitrobenzene were investigated by the batch experiments. The reactive crystallization kinetics associated ammonia feeding rate of 2,4,6-triamino-1,3,5-trinitrobenzene, including nucleation as well as crystal growth, was systematically investigated in the heterogonous semi-batch procedure. The nucleation and crystal growth kinetic exponents were estimated by the linear least-squares method. The crystallization kinetic results indicated that nucleation rate strongly increased but liner growth rate decreased with the increasing of ammonia feeding rate. In terms of manufacturing coarse 2,4,6-triamino-1,3,5-trinitrobenzene, it was found that a slow ammonia feeding rate and a low raw material concentration were feasible under the present experimental conditions.</abstract><cop>Amsterdam</cop><pub>Elsevier B.V</pub><doi>10.1016/j.jcrysgro.2018.03.006</doi><tpages>10</tpages></addata></record> |
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subjects | A1. Growth kinetics A1. Insensitive energetic materials A1. Nucleation A1. Reactive crystallization A2. Semi-batch process Ammonia B1. 2,4,6-Triamino-1,3,5-trinitrobenzene Chemical reactions Crystal growth Crystallization Energetic materials Feeding Fluids Gases High energy physics Hydrocarbons Kinetics Least squares method Material balance Nucleation Organic chemistry Reaction kinetics Temperature effects |
title | Gas-liquid reactive crystallization kinetics of 2,4,6-triamino-1,3,5-trinitrobenzene in the semi-batch procedure |
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