Shock-induced hotspot formation and chemical reaction initiation in PETN containing a spherical void

Journal of Physics: Conference Series

Volumn 500, Issue PART 17, 2014, Pages

  Shan, Tzu Ray ^a   Thompson, Aidan P ^a  

^a SANDIA NATIONAL LABORATORIES   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL REACTIONS; CONDENSED MATTER PHYSICS; REACTION KINETICS; NITROGEN COMPOUNDS;

DOMINANT SPECIES; IMPACT VELOCITIES; PENTAERYTHRITOL TETRANITRATE; REACTION INITIATION; REACTIVE FORCE FIELD; REACTIVE MOLECULAR DYNAMICS; SPHERICAL VOID; VOID COLLAPSE; SHOCK INDUCED;

MOLECULAR DYNAMICS;

EID: 84902340840     PISSN: 17426588     EISSN: 17426596     Source Type: Conference Proceeding    
DOI: 10.1088/1742-6596/500/17/172009     Document Type: Conference Paper

References (23)

1. Johnson J, Tang P and Forest C 1985 J. Appl. Phys. 57 4323-4334
2. Dear J, Field J and Walton A 1988 Nature 332 505-508 (Pubitemid 206245)
3. Dlott D and Fayer M 1990 J. Chem. Phys. 92 3798-3812
4. Tokmakoff A, Fayer M and Dlott D 1993 J. Phys. Chem. 97 1901-1913
5. Mintmire J, Robertson D and White C 1994 Phys. Rev. B 49 14859-14864
6. Kuklja M and Kunz A 1999 J. Phys. Chem. B 103 8427-8431
7. Bourne N and Field J 1999 Proc. R. Soc. Lond. A 455 2411-2426
8. Nomura K, Kalia R K, Nakano A and Vashishta P 2007 Appl. Phys. Lett. 91 183109 (Pubitemid 350037234)
9. Shi Y and Brenner D W 2008 J. Phys. Chem. C 112 6263-6270
10. An Q, Zybin S V, Goddard III W A, Jaramillo-Botero A, Blanco M and Luo S N 2011 Phys. Rev. B 84 220101(R)
11. Budzien J, Thompson A P and Zybin S V 2009 J. Phys. Chem. B 113 13142-13151
12. Zybin S V, Goddard William A I, Xu P, van Duin A C T and Thompson A P 2010 Appl. Phys. Lett. 96 081918
13. Dick J, Mulford R, Spencer W, Pettit D, Garcia E and Shaw D 1991 J. Appl. Phys. 70 3572-3587
14. Dick J 1992 Appl. Phys. Lett. 60 2494-2495
15. Plimpton S 1995 J. Comput. Phys 117 1-19
16. Aktulga H M, Fogarty J C, Pandit S A and Grama A Y 2012 Parallel Comput. 38 245-259
17. van Duin A, Dasgupta S, Lorant F and Goddard W 2001 J. Phys. Chem. A 105 9396-9409
18. Chenoweth K, van Duin A C T and Goddard William A I 2008 J. Phys. Chem. A 112 1040-1053 (Pubitemid 351288190)
19. Shin Y K, Shan T R, Liang T, Noordhoek M J, Sinnott S B, van Duin A C T and Phillpot S R 2012 MRS Bulletin 37 504-512
20. Strachan A, van Duin A, Chakraborty D, Dasgupta S and Goddard W 2003 Phys. Rev. Lett. 91 098301
21. van Duin A, Zeiri Y, Dubnikova F, Kosloff R and Goddard W 2005 J. Am. Chem. Soc. 127 11053-11062 (Pubitemid 41129882)
22. van Duin A C T, Zybin S V, Chenoweth K, Zhang L, Han S P, Strachan A and Goddard William A I 2006 AIP Conf. Proc. vol 845 p 581-584
23. Shan T R, Wixom R R, Mattsson A E and Thompson A P 2013 J. Phys. Chem. B 117 928-936