Multiscale thermodynamics of Ni/Al energetic structural materials under shock

The influence of microstructure on the response of energetic structural materials (ESMs) under shock conditions remains inadequately quantified, and the energy release process is not thoroughly understood. In this work, taking the classical Ni/Al ESM as an example, the shock response was investigated by the shock compression theory with the microstructure-based chemical reaction kinetics model. This theory mainly refers to the equation of the state of multi-component materials with mixture rule, and the reaction at the particle contact interface is built to form the multiscale thermodynamics model. The physical states of material after shock, including relative volume, temperature, and extent of reaction, were analyzed. The results revealed the effect of the burn velocity, particle size and molar ratio on the shock response. Furthermore, the model facilitates a comprehensive understanding of energy release, the extent of the intermetallic reaction, and the oxidation reaction. Despite the involvement of only a small portion of materials in the oxidation reaction, the energy release proportion was comparable to that of the intermetallic reaction. Additionally, insights into the effect of the microstructure on the energy release revealed by the model matched the tests well.