2,4-dinitroanisole(DNAN)is a good replacement for 2,4,6-trinitrotoluene(TNT)in melt-cast explosives due to its superior insensitivity.With the increasing use of DNAN-based melt-cast explosives,the prediction of reacti...2,4-dinitroanisole(DNAN)is a good replacement for 2,4,6-trinitrotoluene(TNT)in melt-cast explosives due to its superior insensitivity.With the increasing use of DNAN-based melt-cast explosives,the prediction of reaction violence and hazard assessment of the explosives subjected to shock is of great significance.This study investigated the shock initiation characteristics for a DNAN-based melt-cast explosive,DHFA,using the one-dimensional Lagrangian apparatus.The embedded manganin gauges in the apparatus record the pressure histories at four Lagrangian positions and show that shock-todetonation transition in DHFA needs a high input shock pressure.The experimental data are analyzed to calibrate the Ignition and Growth model.The calibration is performed using an objective function based on both pressure history and the arrival time of shock.Good agreement between experimental and calculated pressure histories indicates the high accuracy of the calibrated parameters with the optimization method.展开更多
Melt-cast explosives are the most widely used energetic materials in military composite explosives,researchers have been unremittingly exploring high-energy and insensitive melt-cast explosives.In this work,a series o...Melt-cast explosives are the most widely used energetic materials in military composite explosives,researchers have been unremittingly exploring high-energy and insensitive melt-cast explosives.In this work,a series of dinitrophenyl-oxadiazole compounds were designed and prepared.These compounds have an ideal low melting point(80-97℃),good detonation performance(detonation velocity D=6455-6971 m/s,detonation pressure P=18-19 GPa)and extreme insensitive nature(impact sensitivity≥60 J,friction sensitivity>360 N).All these compounds were well characterized by nuclear magnetic resonance,fourier transform infrared spectroscopy,elemental analysis.Compounds 2,3 were unambiguously confirmed by X-ray single crystal diffraction analysis.As a result,their overall properties are superior to traditional melt-cast explosives trinitrotoluene(TNT)and dinitroanisole(DNAN)which may have excellent potential applications in insensitive melt-cast explosives.展开更多
The paper aims to theoretically and numerically investigate the confinement effect of inert materials on the detonation of insensitive high explosives. An improved shock polar theory based on the Zeldovich-von Neumann...The paper aims to theoretically and numerically investigate the confinement effect of inert materials on the detonation of insensitive high explosives. An improved shock polar theory based on the Zeldovich-von Neumann-Döring model of explosive detonation is established and can fully categorize the confinement interactions between insensitive high explosive and inert materials into six types for the inert materials with smaller sonic velocities than the Chapman-Jouguet velocity of explosive detonation. To confirm the theoretical categorization and obtain the flow details, a second-order, cell-centered Lagrangian hydrodynamic method based on the characteristic theory of the two-dimensional first-order hyperbolic partial differential equations with Ignition-Growth chemistry reaction law is proposed and can exactly numerically simulate the confinement interactions. The numerical result confirms the theoretical categorization and can further merge six types of interaction styles into five types for the inert materials with smaller sonic velocity, moreover, the numerical method can give a new type of interaction style existing a precursor wave in the confining inert material with a larger sonic velocity than the Chapman-Jouguet velocity of explosive detonation, in which a shock polar theory is invalid. The numerical method can also give the effect of inert materials on the edge angles of detonation wave front.展开更多
A melt-cast Duan-Zhang-Kim(DZK)mesoscopic reaction rate model is developed for the shock initiation of melt-cast explosives based on the pore collapse hot-spot ignition mechanism.A series of shock initiation experimen...A melt-cast Duan-Zhang-Kim(DZK)mesoscopic reaction rate model is developed for the shock initiation of melt-cast explosives based on the pore collapse hot-spot ignition mechanism.A series of shock initiation experiments was performed for the Comp B melt-cast explosive to estimate effects of the loading pressure and the particle size of granular explosive component,and the mesoscopic model is validated against the experimental data.Further numerical simulations indicate that the initial density and formula proportion greatly affect the hot-spot ignition of melt-cast explosives.展开更多
Searching for insensitive melt-castable energetic materials is still facing great challenges.In this work,we developed a promising strategy that is regulating the ratio of non-covalent interaction by fluorine atoms to...Searching for insensitive melt-castable energetic materials is still facing great challenges.In this work,we developed a promising strategy that is regulating the ratio of non-covalent interaction by fluorine atoms to regulate the melting point to develop new melt-castable energetic materials.Using this method,a highly sym-metric 1,2-difluoro-4,5-dinitrobenzene(DFDNB)was synthesized in one step and fully characterized.DFDNB has a desirable melting point(83.2℃),high decomposition temperature(>400℃),acceptable detonation properties(6786 m s^(-1),21.5 GPa)but superior safety performance(>40 J,>360 N),and excellent chemical compatibility with 1,3,5-trinitro-1,3,5-triazine(RDX)that make it a promising insensitive melt-castable energetic material.A detailed study based on crystal stacking,electrostatic potential,and intermolecular weak interactions in DFDNB and its isomers or analogs demonstrates that non-covalent interactions including the C-F…H,N-O…H hydrogen bonding,and C-F…O halogen-like bonding play an important role in regulating the melting point.展开更多
The design and synthesis of energetic materials with a compatibility of high energy and insensitivity have always been the research fronts in military and civilian fields.Considering excellent performances of porous o...The design and synthesis of energetic materials with a compatibility of high energy and insensitivity have always been the research fronts in military and civilian fields.Considering excellent performances of porous organic frameworks and the lack of research in the field of energetic materials,in this study,a new concept named energetic porous aromatic frameworks(EPAFs)is proposed.The strategy of coating high energy explosives such as 2,4,6,8,10,12-hexanitro-2,4,6,8,10,12-hexaazaisowurtzitane(CL-20)and 1,3,5,7-tetranitro-1,3,5,7-tetrazocane(HMX)in the EPAFs by wet-infiltration method has successfully realized the assembly of target energetic composite materials.The results show that the 75 wt.%CL-20@EPAF-1 possesses the safer impact sensitivity of 31.4 J than that of CL-20(4.0 J).Notably,for 75 wt.%CL-20@EPAF-1,in addition to the superior detonation performances of the detonation velocity(8,761 m·s^(-1))and detonation pressure(31.27 GPa),the synergistic effect of the nitrogen-rich EPAFs and the nitramines high energy explosives results in a higher heat of detonation that surpasses the most of pristine high explosives and reported novel energetic materials.In prospect,energetic porous aromatic frameworks could be a promising and inspiring strategy to build high energy insensitive energetic materials.展开更多
Accurately predicting reactive flow is a challenge when characterizing an explosive under external shock stimuli as the shock initiation time is on the order of a microsecond.The present study constructs a new Ignitio...Accurately predicting reactive flow is a challenge when characterizing an explosive under external shock stimuli as the shock initiation time is on the order of a microsecond.The present study constructs a new Ignition-Growth reaction rate model,which can describe the shock initiation processes of explosives with different initial densities,particle sizes and loading pressures by only one set of model parameters.Compared with the Lee-Tarver reaction rate model,the new Ignition-Growth reaction rate model describes better the shock initiation process of explosives and requires fewer model parameters.Moreover,the shock initiation of a 2,4-Dinitroanisole(DNAN)-based melt-cast explosive RDA-2(DNAN/HMX(octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazoncine)/aluminum)are investigated both experimentally and numerically.A series of shock initiation experiments is performed with manganin piezoresistive pressure gauges and corresponding numerical simulations are carried out with the new Ignition-Growth reaction rate model.The RDA-2 explosive is found to have higher critical initiation pressure and lower shock sensitivity than traditional explosives(such as the Comp.B explosive).The calibrated reaction rate model parameters of RDA-2 could provide numerical basis for its further application.展开更多
基金Scientific Research Foundation for High-level Talents of Anhui University of Science and Technology(Grant No.2021yjrc38)Anhui Provincial Natural Science Foundation(Grant No.2208085QA27)+1 种基金National Natural Science Foundation of China(Grant Nos.11972046,12002266)the authors would like to thank these foundations for financial support.
文摘2,4-dinitroanisole(DNAN)is a good replacement for 2,4,6-trinitrotoluene(TNT)in melt-cast explosives due to its superior insensitivity.With the increasing use of DNAN-based melt-cast explosives,the prediction of reaction violence and hazard assessment of the explosives subjected to shock is of great significance.This study investigated the shock initiation characteristics for a DNAN-based melt-cast explosive,DHFA,using the one-dimensional Lagrangian apparatus.The embedded manganin gauges in the apparatus record the pressure histories at four Lagrangian positions and show that shock-todetonation transition in DHFA needs a high input shock pressure.The experimental data are analyzed to calibrate the Ignition and Growth model.The calibration is performed using an objective function based on both pressure history and the arrival time of shock.Good agreement between experimental and calculated pressure histories indicates the high accuracy of the calibrated parameters with the optimization method.
基金the projects of NSFC(Grant No.22175025)for their generous financial support。
文摘Melt-cast explosives are the most widely used energetic materials in military composite explosives,researchers have been unremittingly exploring high-energy and insensitive melt-cast explosives.In this work,a series of dinitrophenyl-oxadiazole compounds were designed and prepared.These compounds have an ideal low melting point(80-97℃),good detonation performance(detonation velocity D=6455-6971 m/s,detonation pressure P=18-19 GPa)and extreme insensitive nature(impact sensitivity≥60 J,friction sensitivity>360 N).All these compounds were well characterized by nuclear magnetic resonance,fourier transform infrared spectroscopy,elemental analysis.Compounds 2,3 were unambiguously confirmed by X-ray single crystal diffraction analysis.As a result,their overall properties are superior to traditional melt-cast explosives trinitrotoluene(TNT)and dinitroanisole(DNAN)which may have excellent potential applications in insensitive melt-cast explosives.
文摘The paper aims to theoretically and numerically investigate the confinement effect of inert materials on the detonation of insensitive high explosives. An improved shock polar theory based on the Zeldovich-von Neumann-Döring model of explosive detonation is established and can fully categorize the confinement interactions between insensitive high explosive and inert materials into six types for the inert materials with smaller sonic velocities than the Chapman-Jouguet velocity of explosive detonation. To confirm the theoretical categorization and obtain the flow details, a second-order, cell-centered Lagrangian hydrodynamic method based on the characteristic theory of the two-dimensional first-order hyperbolic partial differential equations with Ignition-Growth chemistry reaction law is proposed and can exactly numerically simulate the confinement interactions. The numerical result confirms the theoretical categorization and can further merge six types of interaction styles into five types for the inert materials with smaller sonic velocity, moreover, the numerical method can give a new type of interaction style existing a precursor wave in the confining inert material with a larger sonic velocity than the Chapman-Jouguet velocity of explosive detonation, in which a shock polar theory is invalid. The numerical method can also give the effect of inert materials on the edge angles of detonation wave front.
基金the National Natural Science Foundation of China(Grant No.11772056)the NSAF Joint Fund(Grants No.U1630113)and the Innovative Group of Material and Structure Impact Dynamics(Grant No.11521062)。
文摘A melt-cast Duan-Zhang-Kim(DZK)mesoscopic reaction rate model is developed for the shock initiation of melt-cast explosives based on the pore collapse hot-spot ignition mechanism.A series of shock initiation experiments was performed for the Comp B melt-cast explosive to estimate effects of the loading pressure and the particle size of granular explosive component,and the mesoscopic model is validated against the experimental data.Further numerical simulations indicate that the initial density and formula proportion greatly affect the hot-spot ignition of melt-cast explosives.
基金supported by the National Natural Science Foundation of China(No.22105023).
文摘Searching for insensitive melt-castable energetic materials is still facing great challenges.In this work,we developed a promising strategy that is regulating the ratio of non-covalent interaction by fluorine atoms to regulate the melting point to develop new melt-castable energetic materials.Using this method,a highly sym-metric 1,2-difluoro-4,5-dinitrobenzene(DFDNB)was synthesized in one step and fully characterized.DFDNB has a desirable melting point(83.2℃),high decomposition temperature(>400℃),acceptable detonation properties(6786 m s^(-1),21.5 GPa)but superior safety performance(>40 J,>360 N),and excellent chemical compatibility with 1,3,5-trinitro-1,3,5-triazine(RDX)that make it a promising insensitive melt-castable energetic material.A detailed study based on crystal stacking,electrostatic potential,and intermolecular weak interactions in DFDNB and its isomers or analogs demonstrates that non-covalent interactions including the C-F…H,N-O…H hydrogen bonding,and C-F…O halogen-like bonding play an important role in regulating the melting point.
基金supported by the Key Project of National Defense Basic Research Program of China(No.2019-JCJQ-ZD-139-00)the National Natural Science Foundation of China(No.22075040).
文摘The design and synthesis of energetic materials with a compatibility of high energy and insensitivity have always been the research fronts in military and civilian fields.Considering excellent performances of porous organic frameworks and the lack of research in the field of energetic materials,in this study,a new concept named energetic porous aromatic frameworks(EPAFs)is proposed.The strategy of coating high energy explosives such as 2,4,6,8,10,12-hexanitro-2,4,6,8,10,12-hexaazaisowurtzitane(CL-20)and 1,3,5,7-tetranitro-1,3,5,7-tetrazocane(HMX)in the EPAFs by wet-infiltration method has successfully realized the assembly of target energetic composite materials.The results show that the 75 wt.%CL-20@EPAF-1 possesses the safer impact sensitivity of 31.4 J than that of CL-20(4.0 J).Notably,for 75 wt.%CL-20@EPAF-1,in addition to the superior detonation performances of the detonation velocity(8,761 m·s^(-1))and detonation pressure(31.27 GPa),the synergistic effect of the nitrogen-rich EPAFs and the nitramines high energy explosives results in a higher heat of detonation that surpasses the most of pristine high explosives and reported novel energetic materials.In prospect,energetic porous aromatic frameworks could be a promising and inspiring strategy to build high energy insensitive energetic materials.
基金supported by the Innovative Group of Material and Structure Impact Dynamics(Grant No.11521062)。
文摘Accurately predicting reactive flow is a challenge when characterizing an explosive under external shock stimuli as the shock initiation time is on the order of a microsecond.The present study constructs a new Ignition-Growth reaction rate model,which can describe the shock initiation processes of explosives with different initial densities,particle sizes and loading pressures by only one set of model parameters.Compared with the Lee-Tarver reaction rate model,the new Ignition-Growth reaction rate model describes better the shock initiation process of explosives and requires fewer model parameters.Moreover,the shock initiation of a 2,4-Dinitroanisole(DNAN)-based melt-cast explosive RDA-2(DNAN/HMX(octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazoncine)/aluminum)are investigated both experimentally and numerically.A series of shock initiation experiments is performed with manganin piezoresistive pressure gauges and corresponding numerical simulations are carried out with the new Ignition-Growth reaction rate model.The RDA-2 explosive is found to have higher critical initiation pressure and lower shock sensitivity than traditional explosives(such as the Comp.B explosive).The calibrated reaction rate model parameters of RDA-2 could provide numerical basis for its further application.
