| Citation: | Wang Hanyu, Ma Xiao, Ma Yuncan, Chu Genbai, Ding Kai, Tu Shaoyong, Fu Hua, Zheng Xianxu, Wang Xinjie, Cao Zhurong, Huang Fenglei. Micrometer-scale pore collapse mechanisms in shocked HMX single crystal: Experiments and simulations[J]. Matter and Radiation at Extremes, 2026, 11(3): 037603. doi: 10.1063/5.0300508 |
| [1] |
C. A. Handley, B. D. Lambourn, N. J. Whitworth, H. R. James, and W. J. Belfield, “Understanding the shock and detonation response of high explosives at the continuum and meso scales,” Appl. Phys. Rev. 5, 011303 (2018).10.1063/1.5005997
|
| [2] |
M. P. Kroonblawd and L. E. Fried, “High explosive ignition through chemically activated nanoscale shear bands,” Phys. Rev. Lett. 124, 206002 (2020).10.1103/physrevlett.124.206002
|
| [3] |
P. Malhotra, T. Jiao, D. L. Henann, R. J. Clifton, and P. R. Guduru, “Dynamic shearing resistance of an energetic material simulant: Sucrose,” J. Mech. Phys. Solids 159, 104624 (2022).10.1016/j.jmps.2021.104624
|
| [4] |
M. A. Wood, D. E. Kittell, C. D. Yarrington, and A. P. Thompson, “Multiscale modeling of shock wave localization in porous energetic material,” Phys. Rev. B 97, 014109 (2018).10.1103/physrevb.97.014109
|
| [5] |
M. Chaudhri, “The initiation of fast decomposition in solid explosives by fracture, plastic flow, friction and collapsing voids,” in Proceedings of the Ninth Symposium (International) on Detonation, Portland, OR (U.S. Office of Naval Research, 1989), pp. 331–339.
|
| [6] |
K. Yang, Y. Wu, and F. Huang, “Damage and hotspot formation simulation for impact–shear loaded PBXs using combined microcrack and microvoid model,” Eur. J. Mech. A/Solids 80, 103924 (2020).10.1016/j.euromechsol.2019.103924
|
| [7] |
R. Menikoff, “On beyond the standard model for high explosives: Challenges & obstacles to surmount,” AIP Conf. Proc. 1195, 18–25 (2009).10.1063/1.3295100
|
| [8] |
R. Menikoff, “Pore collapse and hot spots in HMX,” AIP Conf. Proc. 706, 393–396 (2004).10.1063/1.1780261
|
| [9] |
Y. Long and J. Chen, “A molecular dynamics study of the early-time mechanical heating in shock-loaded octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine-based explosives,” J. Appl. Phys. 116, 033516 (2014).10.1063/1.4890715
|
| [10] |
B. Lambourn and C. Handley, “A two-temperature model for shocked porous explosive,” AIP Conf. Proc. 1793, 120025 (2017).10.1063/1.4971707
|
| [11] |
C. A. Duarte, A. Hamed, J. D. Drake, C. J. Sorensen, S. F. Son et al., “Void collapse in shocked-HMX single crystals: Simulations and experiments,” Propellants, Explos., Pyrotech. 45, 243–253 (2020).10.1002/prep.201900251
|
| [12] |
N. K. Rai, E. M. Escauriza, D. E. Eakins, and H. S. Udaykumar, “Mechanics of shock induced pore collapse in poly(methyl methacrylate) (PMMA): Comparison of simulations and experiments,” J. Mech. Phys. Solids 143, 104075 (2020).10.1016/j.jmps.2020.104075
|
| [13] |
E. M. Escauriza, J. P. Duarte, D. J. Chapman, M. E. Rutherford, L. Farbaniec et al., “Collapse dynamics of spherical cavities in a solid under shock loading,” Sci. Rep. 10, 8455 (2020).10.1038/s41598-020-64669-y
|
| [14] |
X. Ma, X. Li, X. Zheng, W. Guo, and J. Li, “Weak shock loadings induce potential hot spots formation around an intergranular pore,” J. Appl. Phys. 121, 115102 (2017).10.1063/1.4978355
|
| [15] |
X. Ma, K. Zhang, H. Shang, J. Li, T. Li et al., “Measuring crack growth and rise in temperature around a cylindrical defect in explosive simulants under low-pressure and long-pulse loadings,” Propellants, Explos., Pyrotech. 45, 1654–1661 (2020).10.1002/prep.202000057
|
| [16] |
J. Lind, M. D. Nelms, A. K. Robinson, M. Kumar, and N. R. Barton, “Examining material constitutive response under dynamic compression and large plastic strains using in situ imaging of hole closure,” Acta Mater. 206, 116584 (2021).10.1016/j.actamat.2020.116584
|
| [17] |
M. A. Zikry, “Dynamic void collapse and material failure mechanisms in metallic crystals,” Mech. Mater. 17, 273–288 (1994).10.1016/0167-6636(94)90065-5
|
| [18] |
S. Nemat-Nasser and S.-N. Chang, “Compression-induced high strain rate void collapse, tensile cracking, and recrystallization in ductile single and polycrystals,” Mech. Mater. 10, 1–17 (1990).10.1016/0167-6636(90)90013-6
|
| [19] |
Y. Chen, “The parallel algorithms of wavefront computing in adaptive optics,” Acta Opt. Sin. 19, 72–80 (1999).
|
| [20] |
M. Nelms, J. Lind, J. Margraf, S. Basim Qamar, J. Herrington et al., “High-rate strength response of tantalum from dynamic hole closure experiments,” J. Appl. Phys. 132, 175102 (2022).10.1063/5.0107391
|
| [21] |
Z. Lovinger and R. Kositski, “Shear localization as a damage mechanism in pore collapse under shock compression,” Int. J. Impact Eng. 193, 105039 (2024).10.1016/j.ijimpeng.2024.105039
|
| [22] | |
| [23] |
C. J. Blum-Sorensen, C. A. Duarte, J. D. Drake, N. E. Kerschen, K. Fezzaa et al., “Phase contrast X-ray imaging of the collapse of an engineered void in single-crystal HMX,” Propellants, Explos., Pyrotech. 47, e202100297 (2022).10.1002/prep.202100297
|
| [24] |
S. Roy, B. P. Johnson, X. Zhou, Y. T. Nguyen, D. D. Dlott et al., “Hot spot ignition and growth from tandem micro-scale simulations and experiments on plastic-bonded explosives,” J. Appl. Phys. 131, 205901 (2022).10.1063/5.0085356
|
| [25] |
J. E. Field, “Hot spot ignition mechanisms for explosives,” Acc. Chem. Res. 25, 489–496 (1992).10.1021/ar00023a002
|
| [26] |
C. M. Tarver, S. K. Chidester, and A. L. Nichols, “Critical conditions for impact- and shock-induced hot spots in solid explosives,” J. Phys. Chem. 100, 5794–5799 (1996).10.1021/jp953123s
|
| [27] |
O. Sen, P. K. Seshadri, N. K. Rai, J. Larentzos, J. Brennan et al., “Johnson–cook yield functions for cyclotetramethylene-tetranitramine (HMX) and cyclotrimethylene-trinitramine (RDX) derived from single crystal plasticity models,” J. Appl. Phys. 135, 145901 (2024).10.1063/5.0188263
|
| [28] |
J. Herrin, G. Tow, J. Brennan, J. Larentzos, C. R. Picu et al., “Pore collapse, shear bands, and hotspots using atomistics-consistent continuum models for RDX (1,3,5-trinitro-1,3,5-triazinane): Comparison with molecular dynamics calculations,” J. Appl. Phys. 136, 135901 (2024).10.1063/5.0232182
|
| [29] |
P. Zhao, S. Lee, T. Sewell, and H. S. Udaykumar, “Tandem molecular dynamics and continuum studies of shock‐induced pore collapse in TATB,” Propellants, Explos., Pyrotech. 45, 196–222 (2020).10.1002/prep.201900382
|
| [30] |
H. K. Springer, S. Bastea, A. L. Nichols III, C. M. Tarver, and J. E. Reaugh, “Modeling the effects of shock pressure and pore morphology on hot spot mechanisms in HMX,” Propellants, Explos., Pyrotech. 43, 805–817 (2018).10.1002/prep.201800082
|
| [31] |
C. A. Duarte, C. Li, B. W. Hamilton, A. Strachan, and M. Koslowski, “Continuum and molecular dynamics simulations of pore collapse in shocked β-tetramethylene tetranitramine (β-HMX) single crystals,” J. Appl. Phys. 129, 015904 (2021).10.1063/5.0025050
|
| [32] |
K. Ding, X. Wang, and F. Huang, “Shock-induced nanoscale pore collapse and hotspot in cyclotetramethylene tetranitramine (HMX),” Int. J. Mech. Sci. 281, 109644 (2024).10.1016/j.ijmecsci.2024.109644
|
| [33] |
X. Wang, Z. Duan, Z. Bai, and F. Huang, “Crystal-scale modelling of pore collapse in cyclotetramethylene tetranitramine (HMX) under different shock strengths,” Mech. Mater. 174, 104457 (2022).10.1016/j.mechmat.2022.104457
|
| [34] |
P. Das, P. Zhao, D. Perera, T. Sewell, and H. S. Udaykumar, “Molecular dynamics-guided material model for the simulation of shock-induced pore collapse in β-octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine (β-HMX),” J. Appl. Phys. 130, 085901 (2021).10.1063/5.0056560
|
| [35] |
Y. T. Nguyen, C. Okafor, P. Zhao, O. Sen, C. R. Picu et al., “Continuum models for meso-scale simulations of HMX (1,3,5,7-tetranitro-1,3,5,7-tetrazocane) guided by molecular dynamics: Pore collapse, shear bands, and hotspot temperature,” J. Appl. Phys. 136, 114902 (2024).10.1063/5.0232413
|
| [36] |
T. Zhou and J. Lou, “Molecular dynamic studies on the shock responses of energetic crystal HMX with cylindrical voids,” Chin. J. Energ. Mater. 32, 65–75 (2023).10.11943/CJEM2023167.
|
| [37] |
H. K. Springer, C. M. Miller, M. P. Kroonblawd, and S. Bastea, “Simulating the effects of grain surface morphology on hot spots in HMX with surrogate model development,” Propellants, Explos., Pyrotech. 48, e202200139 (2023).10.1002/prep.202200139
|
| [38] |
T. D. Sewell and R. Menikoff, “Complete equation of state for β‐HMX and implications for initiation,” AIP Conf. Proc. 706, 157–162 (2004).10.1063/1.1780207
|
| [39] |
D. J. Steinberg, S. G. Cochran, and M. W. Guinan, “A constitutive model for metals applicable at high‐strain rate,” J. Appl. Phys. 51, 1498–1504 (1980).10.1063/1.327799
|
| [40] |
Z. Zhang, M. Khan, and C. R. Picu, “Mechanism-informed constitutive modeling of molecular crystal cyclotetramethylene tetranitramine (β-HMX),” Int. J. Plast. 169, 103722 (2023).10.1016/j.ijplas.2023.103722
|
| [41] |
A. Pereverzev and T. Sewell, “Elastic coefficients of β-HMX as functions of pressure and temperature from molecular dynamics,” Crystals 10, 1123 (2020).10.3390/cryst10121123
|
| [42] |
Z. Zhang and C. R. Picu, “Homogeneous dislocation nucleation in molecular crystal cyclotetramethylene-tetranitramine (β‐HMX),” Propellants, Explos., Pyrotech. 47, e202100381 (2022).10.1002/prep.202100381
|
| [43] |
R. Ma, W. Sun, C. R. Picu, and T. Sewell, “Domain partitioning material point method for simulating shock in polycrystalline energetic materials,” Comput. Methods Appl. Mech. Eng. 404, 115815 (2023).10.1016/j.cma.2022.115815
|
| [44] |
M. P. Kroonblawd and R. A. Austin, “Sensitivity of pore collapse heating to the melting temperature and shear viscosity of HMX,” Mech. Mater. 152, 103644 (2021).10.1016/j.mechmat.2020.103644
|
| [45] |
T. R. Gibbs and A. Popolato, LASL Explosive Property Data (University of California Press, 1980), pp. 42–51.
|
| [46] |
K. Ding, X. Wang, and F. Huang, “Pore size effect on hotspot formation in shocked explosive crystal,” Int. J. Mech. Sci. 305, 110745 (2025).10.1016/j.ijmecsci.2025.110745
|