Defect evolution and pore collapse in crystalline energetic materials

Modelling and Simulation in Materials Science and Engineering

Volumn 17, Issue 3, 2009, Pages

  Barton, Nathan R ^a   Winter, Nicholas W ^a   Reaugh, John E ^a  

^a LAWRENCE LIVERMORE NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CONTINUUM MECHANICS; CRYSTALLINE MATERIALS; ELASTICITY; GRAFTING (CHEMICAL); MOLECULAR DYNAMICS; REACTION KINETICS; SINGLE CRYSTALS; SYNTHESIS (CHEMICAL);

CRYSTAL MECHANICS; DEFECT EVOLUTIONS; DEFECT GENERATIONS; DYNAMIC LOADINGS; ENERGETIC MATERIALS; EXPERIMENTAL OBSERVATIONS; GAS GUNS; PHYSICAL LENGTHS; PORE COLLAPSE; STRAIN LOCALIZATIONS; TEST BEDS; WAVE MOTIONS;

DYNAMICS;

EID: 63749083427     PISSN: 09650393     EISSN: 1361651X     Source Type: Journal    
DOI: 10.1088/0965-0393/17/3/035003     Document Type: Article

References (55)

1. Bowden F P and Yoffe A D 1952 Initiation and Growth of Explosions in Liquids and Solids (Cambridge: Cambridge University Press)
2. Dick J J, Hooks D E, Menikoff R and Martinez A R 2004 Elastic-plastic wave profiles in cyclotetramethylene tetranitramine crystals J. Appl. Phys. 96 364-79
3. Hooks D E and Ramos K J 2006 Initiation mechanisms in single crystal explosives: dislocations, elastic limits, and initiation thresholds Proc. 13th Int. Detonation Symp. (Norfolk, VA)
4. Walley S M, Field J E and Greenaway M W 2006 Crystal sensitivities of energetic materials Mater. Sci. Technol. 22 402-13
5. Bourne N K and Milne A M 2003 On cavity collapse and subsequent ignition Proc. 12th Int. Detonation Symp. (San Diego, CA) ed J M Short and D G Tasker p 213
6. Sheen D B, Sherwood J N, Gallagher H G, Littlejohn A H and Pearson A 1993 An investigation of mechanically induced lattice defects in energetic materials Technical Report University of Strathclyde, Department of Pure and Applied Chemistry, Glasgow G1 1XL, Scotland UK US Navy Grant No. N00014-87-J-1173
7. Rae P J, Hooks D E and Liu C 2006 The stress versus strain response of single β-hmx crystals in quasi-static compression Proc. 13th Int. Detonation Symp. (Norfolk, VA)
8. Marian J, Cai W and Bulatov V V 2004 Dynamic transitions from smooth to rough to twinning in dislocation motion Nature Mater. 3 158-63
9. Cawkwell M J, Sewell T D, Ramos K J and Hooks D E 2008 private communication
10. Menikoff R and Sewell T D 2002 Constituent properties of HMX needed for mesoscale simulations Combust. Theory Modelling 6 103-25
11. Armstrong R W and Elban W L 2006 Materials science and technology aspects of energetic (explosive) materials Mater. Sci. Technol. 22 381-95
12. Benson D J and Conley P 1999 Eulerian finite-element simulations of experimentally acquired HMX microstructures Modelling Simul. Mater. Sci. Eng. 7 333-54
13. Menikoff R, Dick J J and Hooks D E 2005 Analysis of wave profiles for single-crystal cyclotetramethylene tetranitramine J. Appl. Phys. 97 023529
14. Baer M R 2002 Modeling heterogeneous energetic materials at the mesoscale Thermochim. Acta 384 351-67
15. Sewell T D, Menikoff R, Bedrov D and Smith G D 2003 A molecular dynamics simulation study of elastic properties of HMX J. Chem. Phys. 119 7417-26
16. Menikoff R 2003 Pore collapse and hot spots in HMX APS Topical Conf.: Shock Compression of Condensed Matter (Portland, OR)
17. Barton N R, Benson D J and Becker R 2004 Crystal level simulations using Eulerian finite element methods Materials Processing and Design: Modeling, simulation and Applications AIP Conf. Proc. (Columbus, OH) vol 712 pp 1624-9 NUMIFORM
18. Barton N R, Benson D J and Becker R 2005 Crystal level continuum modelling of phase transformations: the α ↔ ε transformation in iron Modelling Simul. Mater. Sci. Eng. 13 707-31
19. Barton N R, Knap J, Arsenlis A, Becker R, Hornung R D and Jefferson D R 2008 Embedded polycrystal plasticity and adaptive sampling Int. J. Plast. 24 242-66
20. Barton N, Reaugh J and Winter N 2008 Crystal level modeling of energetic materials Proc. 14th Int. Symp. on Plasticity (Kailua-Kona, Hawaii, January 2008) (Fulton, MD: Neat Press)
21. Anderson A, Cooper R, Neely R, Nichols A, Sharp R and Wallin B 2003 Users manual for ALE3D-an arbitrary Lagrange/Eulerian 3D code system Technical Report UCRL-MA-152204 Lawrence Livermore National Laboratory
22. Benson D J 1992 Computational methods in Lagrangian and Eulerian hydrocodes Comput. Methods Appl. Mech. Eng. 99 235-394
23. Prentice M J 1986 Orientation statistics without parametric assumptions J. R. Stat. Soc. B 48 214-22
24. Krieger Lassen N C, Jensen D J and Conradsen K 1994 On the statistical analysis of orientation data Acta Crystallogr. A 50 741-8
25. Arsenlis A, Parks D M, Becker R and Bulatov V V 2004 On the evolution of crystallographic dislocation density in non-homogeneously deforming crystals J. Mech. Phys. Solids
26. Taupin V, Varadhan S, Fressengeas C and Beaudoin A J 2008 Directionality of yield point in strain-aged steels: the role of polar dislocations Acta Mater. 56 3002-10
27. Gerken J M and Dawson P R 2008 A crystal plasticity model that incorporates stresses and strains due to slip gradients J. Mech. Phys. Solids 56 1651-72
28. Becker R 2004 Effects of crystal plasticity on materials loaded at high pressures and strain rates Int. J. Plast. 20 1983-2006
29. Gurtin M E and Spear K 1983 On the relationship between the logarithmic strain rate and the stretching tensor Int. J. Solids Struct. 19 437-44
30. Hoger A 1987 The stress conjugate to logarithmic strain Int. J. Solids Struct. 23 1645-56
31. Drumheller D S 1998 Introduction to Wave Propagation in Nonlinear Fluids and Solids (Cambridge: Cambridge University Press)
32. Sewell T D 2008 personal communication
33. Stevens L L and Eckhardt C J 2005 The elastic constants and related properties of beta-HMX determined by Brillouin scattering J. Chem. Phys. 122 174701
34. Zaug J M 1998 Elastic constants of β-HMX and tantalum, equations of state of supercritical fluids and fluid mixtures and thermal transport determinations Proc. 11th Int. Symp. on Detonation (Snowmass, CO, 31 August-4 September 1998) p 498
35. Goddard W A, Meiron D I, Ortiz M, Shepherd J E and Pool J 1998 Annual Technical Report. Technical Report Center for Simulation of Dynamic Response in Materials, California Institute of Technology
36. Sewell T D and Menikoff R 2003 Complete equation of state for beta-HMX and implications for initiation Shock Compression of Condensed Matter-2003 AIP Conf. Proc. (Portland, OR) vol 706 ed M D Furnish et al
37. Bedrov D, Smith G D and Sewell T D 2000 Temperature-dependent shear viscosity coefficient of octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine (HMX): a molecular dynamics simulation study J. Chem. Phys. 112 7203-8
38. Gillis P P, Gilman J J and Taylor J W 1969 Stress dependences of dislocation velocities Phil. Mag. 20 279
39. Meyers M A 1994 Dynamic Behavior of Materials (New York: Wiley)
40. Gilman J J 1969 Materials science and engineering Micromechanics of flow in solids (New York: McGraw-Hill)
41. Hiratani M and Nadgorny E M 2001 Combined model of dislocation motion with thermally activated and drag-dependent stages Acta Mater. 49 4337-46
42. Barton N R and Wenk H-R 2007 Dauphiné twinning in polycrystalline quartz Modelling Simul. Mater. Sci. Eng. 15 369-94
43. Abeyaratne R and Knowles J K 1993 A continuum model for a thermoelastic solid capable of undergoing phase transitions J. Mech. Phys. Solids 41 541-71
44. Devincre B, Hoc T and Kubin L 2008 Dislocation mean free paths and strain hardening of crystals Science 320 1745-8
45. Arsenlis A, Cai W, Tang M, Rhee M, Oppelstrup T, Hommes G, Pierce T G and Bulatov V V 2007 Enabling strain hardening simulations with dislocation dynamics Modelling Simul. Mater. Sci. Eng. 15 553-95
46. Preston D L, Tonks D L and Wallace D C 2003 Model of plastic deformation for extreme loading conditions J. Appl. Phys. 93 211-20
47. Johnson J N 1993 Micromechanical considerations in shock compression of solids High-Pressure Shock Compression of Solids ed J R Asay and M Shahinpoor (Berlin: Springer) pp 217-64 chapter 7
48. Asay J R, Fowles G R, Duvall G E, Miles M H and Tinder R F 1972 Effects of point defects on elastic precursor decay in LiF J. Appl. Phys. 43 2132-45
49. Mecking H and Kocks U F 1981 Kinetics of flow and strain-hardening Acta Metall. 29 1865-75
50. Johnson J N, Jones O E and Michaels T E 1970 Dislocation dynamics and single-crystal constitutive relations: shock-wave propagation and precursor decay J. Appl. Phys. 41 2330-9
51. Swift D C, Loomis E N, Peralta P and El-Dasher B 2008 Crystal plasticity for dynamic loading at high pressures and strains Phys. Rev. B submitted (arXiv:0801:0271)
52. Springer H K 2008 Meso-scale modeling of spall in a heterogeneous, two-phase material PhD Thesis University of California, Davis
53. Tanguy D, Mareschal M, Lomdahl P S, Germann T C, Holian B L and Ravelo R 2003 Dislocation nucleation induced by a shock wave in a perfect crystal: molecular dynamics simulations and elastic calculations Phys. Rev. B 68 144111
54. Li J, Zhu T, Yip S, Van Vliet K J and Suresh S 2004 Elastic criterion for dislocation nucleation Mater. Sci. Eng. A 365 25-30
55. Office of Naval Research 2006 Proc. 13th Int. Detonation Symp. (Norfolk, VA)