RESEARCH PAPER · Journal of Cluster Science · 2026
Sc-Induced Modulation of Structural Distortion, Chemical Stability Trade-Off, and Nonlinear Optical Response in X12Y12 (X = B, Al, C, Si, Ge, Li, Zn, Cd, Pb, Sb, Bi, Cu; Y = N, P, O, F, Cl) Nanocages: a DFT Perspective
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