Effect of initial temperature on the plastic deformation of Al/Ni self-propagation welding by molecular dynamics study

This study investigates the impact of initial temperature on the microstructure and mechanical properties of welded components, using molecular dynamics (MD). The stress–strain curves of the welded components, following various initial temperature treatments, revealed a double yielding phenomenon. Notably, there was a significant strain difference of 19.7% between the two yields. When the strain was loaded to the point of doubling yielding, stacking faults and twins covered the aluminum component part, while no such observations were made in the nickel component part. Additionally, tensile cracking occurred in the aluminum component part. The results indicate that treatment at varying initial temperatures alters the internal structure of the welded components. After the material yielded the first time, a significant number of disordered atoms and Shockley partial dislocations emerge, resulting in a substantial buildup of dislocation tangles and reduced dislocation migration rates. Consequently, the material exhibits a phenomenon of double yielding, with dislocation slip and deformation serving as the primary mechanisms. The optimal mechanical properties of the welded components achieved an initial temperature of 200[Formula: see text]K. Additionally, the effect of tensile temperature on the mechanical properties of the welded components were analyzed, and similar observations of double yielding were made. The significant number of dislocation tangles served as a barrier to dislocation slip, effectively enhancing the material’s mechanical properties. The simulation results provide theoretical support for the development of aluminum–nickel multilayer film self-propagation welding process.