Time evolution and asymmetry of a laser produced blast wave
PHYSICS OF PLASMAS 24:10 (2017) ARTN 103124
Identifying deformation mechanisms in molecular dynamics simulations of laser shocked matter
Journal of Computational Physics Elsevier 350 (2017) 16-24
Abstract:
In this paper we demonstrate a new post-processing technique that allows straightforward identification of deformation mechanisms in molecular dynamics simulations. We utilise reciprocal space methods by calculating a per-atom structure factor (PASF) to visualise changes in volume, orientation and structure, thus allowing unambiguous discrimination between key deformation/relaxation mechanisms such as uniaxial strain, twinning and structural phase transformations. The full 3-D PASF is reduced to a 2-D representation by taking only those points which lie on the surface of an ellipsoid passing through the nearest reciprocal lattice points. Projecting this 2-D representation onto the set of spherical harmonics allows for a numerical characterisation of the system state that easily captures various plastic deformation mechanisms that have been historically difficult to identify. The technique is used to successfully classify high temperature twinning rotations in shock compressed tantalum and to identify the α to ω phase transition in group-IV hcp metals.Interaction of a highly radiative shock with a solid obstacle
Physics of Plasmas American Institute of Physics 24:8 (2017) 082707