Structural Signature of β-Relaxation in La-Based Metallic Glasses

The secondary β-relaxation is an intrinsic feature in glassy materials. However, its structural origin is still not well understood. Here we report that the β-relaxations in La₅₀Al₁₅Ni₃₅ and La₅₀Al₁₅Cu₃₅ metallic glasses (MGs) mainly depend on the vibration of small Ni and Cu atoms in local cages. By using advanced synchrotron X-ray techniques and theoretical calculations, we elucidate that the tricapped-trigonal-prism-like polyhedra with more large La atoms in shells favor the local vibration of center Ni atoms, leading to the pronounced β-relaxation event. In contrast, the in-cage vibration of Cu atoms is somehow suppressed by the appearance of more shell Cu atoms. Nevertheless, they could easily diffuse out of the cages compared with Ni, thus triggering the onset of α-relaxation. This work provides a pathway to understand the different structural relaxation behaviors in MGs and other disordered materials from their local atomic packing and dynamics points of view.