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    Large-scale molecular dynamics simulations of shock induced plasticity in tantalum single crystals 

    Ravelo, Ramon; An, Qi; Germann, Timothy C.; Holian, Brad L. (AIP Publishing, 2012)
    We report on large-scale non-equilibrium molecular dynamics (NEMD) simulations of shock wave compression in Ta single crystals. The atomic interactions are modeled via a recently developed and optimized embedded-atom method ...
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    Shock compression and spallation of single crystal tantalum 

    An, Qi; Ravelo, Ramon; Germann, Timothy C.; Han, Weizhong; Luo, Sheng-Nian; Tonks, D. L.; Goddard III, William A. (AIP Publishing, 2012)
    We present molecular dynamics simulations of shock-induced plasticity and spall damage in single crystal Ta described by a recently developed embedded-atom-method (EAM) potential and a volumedependent qEAM potential. We ...