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Heim AJ, Grønbech-Jensen N, Kober EM, et al. Molecular dynamics simulations of detonation instability. Phys Rev E Stat Nonlin Soft Matter Phys. 2008;78(4):046710doi: 10.1103/PhysRevE.78.046710.
Heim, A. J., Grønbech-Jensen, N., Kober, E. M., & Germann, T. C. (2008). Molecular dynamics simulations of detonation instability. Physical review. E, Statistical, nonlinear, and soft matter physics, 78(4), 046710. https://doi.org/10.1103/PhysRevE.78.046710
Heim, Andrew J, et al. "Molecular dynamics simulations of detonation instability." Physical review. E, Statistical, nonlinear, and soft matter physics vol. 78,4 (2008): 046710. doi: https://doi.org/10.1103/PhysRevE.78.046710
Heim AJ, Grønbech-Jensen N, Kober EM, Germann TC. Molecular dynamics simulations of detonation instability. Phys Rev E Stat Nonlin Soft Matter Phys. 2008 Oct;78(4):046710. doi: 10.1103/PhysRevE.78.046710. Epub 2008 Oct 28. PMID: 18999564.
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Phys Rev E Stat Nonlin Soft Matter Phys. 2008 Oct;78(4):046710. doi: 10.1103/PhysRevE.78.046710. Epub 2008 Oct 28.

Molecular dynamics simulations of detonation instability.

Physical review. E, Statistical, nonlinear, and soft matter physics

Andrew J Heim, Niels Grønbech-Jensen, Edward M Kober, Timothy C Germann

Affiliations

  1. Department of Applied Science, University of California, Davis, California 95616, USA.

PMID: 18999564 DOI: 10.1103/PhysRevE.78.046710

Abstract

After making modifications to the reactive empirical bond-order potential for molecular dynamics (MD) of Brenner et al. [Phys. Rev. Lett.70, 2174 (1993); 76, 2202(E) (1996)] in order to make the model behave in a more conventional manner, we discover that the updated model exhibits detonation instability, a first for MD. The instability is analyzed in terms of the accepted theory.

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