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Effects of nano-sized aluminum on detonation characteristics and metal acceleration for RDX-based aluminized explosive

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Defence Technology（防务技术） 2021年第2期17卷 327-337页

作者： Dan-yang Liu Pin Zhao serene hay-yee chan Huey Hoon Hng Lang Chen State Key Laboratory of Explosion Science and Technology Beijing Institute of TechnologyBeijing100081China School of Materials Science and Engineering Nanyang Technological University639798Singapore

Nano-sized aluminum(Nano-Al)powders hold promise in enhancing the total energy of explosives and the metal acceleration ability at the same ***,the near-detonation zone effects of reaction between Nano-Al with detonation products remain *** this study,the overall reaction process of 170 nm Al with RDX explosive and its effect on detonation characteristics,detonation reaction zone,and the metal acceleration ability were comprehensively investigated through a variety of experiments such as the detonation velocity test,detonation pressure test,explosive/window interface velocity test and confined plate push test using high-resolution laser *** fluoride(LiF),which has an inert behavior during the explosion,was used as a control to compare the contribution of the reaction of aluminum.A thermochemical approach that took into account the reactivity of aluminum and ensuing detonation products was adopted to calculate the additional energy release by *** the numerical simulations based on the calculated afterburn energy and experimental results,the parameters in the detonation equation of state describing the Nano-Al reaction characteristics were *** study found that when the 170 nm Al content is from 0%to 15%,every 5%increase of aluminum resulted in about a 1.3%decrease in detonation *** pressure gauge measurement showed no significant enhancement in detonation *** detonation reaction time and reaction zone length of RDX/Al/wax/80/15/5 explosive is 64 ns and 0.47 mm,which is respectively 14%and 8%higher than that of RDX/wax/95/5 explosive(57 ns and 0.39 mm).Explosive/window interface velocity curves show that 170 nm Al mainly reacted with the RDX detonation products after the detonation *** the recording time of about 10 ms throughout the plate push test duration,the maximum plate velocity and plate acceleration time accelerated by RDX/Al/wax/80/15/5 explosive is 12%and 2.9 ms higher

关键词： Nano-sized aluminum Detonation reaction zone Explosive metal acceleration Thermodynamic equilibrium calculation Laser interferometry

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Accurate machine learning models based on small dataset of energetic materials through spatial matrix featurization methods

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Journal of Energy Chemistry 2021年第12期30卷 364-375,I0009页

作者： Chao Chen Danyang Liu Siyan Deng Lixiang Zhong serene hay yee chan Shuzhou Li Huey Hoon Hng School of Materials Science and Engineering Nanyang Technological University50 Nanyang AvenueSingapore 639798Singapore

A large database is desired for machine learning(ML) technology to make accurate predictions of materials physicochemical properties based on their molecular *** a large database is not available,the development of proper featurization method based on physicochemical nature of target proprieties can improve the predictive power of ML models with a smaller *** this work,we show that two new featurization methods,volume occupation spatial matrix and heat contribution spatial matrix,can improve the accuracy in predicting energetic materials' crystal density(ρ_(crystal)) and solid phase enthalpy of formation(H_(f,solid)) using a database containing 451 energetic *** mean absolute errors are reduced from 0.048 g/cm~3 and 24.67 kcal/mol to 0.035 g/cm~3 and 9.66 kcal/mol,*** leave-one-out-cross-validation,the newly developed ML models can be used to determine the performance of most kinds of energetic materials except *** ML models are applied to predict ρ_(crystal) and H_(f,solid) of CHON-based molecules of the 150 million sized PubChem database,and screened out 56 candidates with competitive detonation performance and reasonable chemical *** further improvement in future,spatial matrices have the potential of becoming multifunctional ML simulation tools that could provide even better predictions in wider fields of materials science.

关键词： Small database machine learning Energetic materials screening Spatial matrix featurization method Crystal density Formation enthalpy n-Body interactions

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Combustion characteristic and aging behavior of bimetal thermite powders

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Defence Technology（防务技术） 2021年第3期17卷 755-762页

作者： Hong-qi Nie hay yee chan Sreekumar Pisharath Huey Hoon Hng Energetics Research Institute Nanyang Technological UniversitySingapore

Nanothermites have been employed as fuel additives in energetic formulations due to their higher energy density over CHNO energetics. Nevertheless, sintering and degradation of nanoparticles significantly limit the practical use of nanothermites. In this work, combustion characteristic and aging behavior of aluminum/iron oxide(Al/Fe2O3) nanothermite mixtures were investigated in the presence of micron-scale nickel aimed to produce bimetal thermite powders. The results showed that the alumina content in the combustion residue increased from 88.3% for Al/Fe2O3 nanothermite to 96.5% for the nanothermite mixture containing 20 wt% nickel. Finer particle sizes of combustion residue were obtained for the nanothermite mixtures containing nickel, indicative of the reduced agglomeration. Both results suggested a more complete combustion in the bimetal thermite powders. Aging behavior of the nanothermite mixture was also assessed by measuring the heat of combustion of the mixture before and after aging process. The reduction in heat of combustion of nanothermite mixtures containing nickel was less severe as compared to a significant decrease for the nanothermite mixture without nickel, indicating better aging resistance of the bimetal thermite powders.

关键词： Nanothermite Bimetal Combustion efficiency Aging Thermochemical calculations

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