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Sponsored Artificial Intelligence: A Modern Approach, Global Edition Artificial Intelligence: A Modern Approach, Global Edition

Author

Bo Xu

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Aug 2026

Carrier-Lattice Coupling Drives Oxidative Degradation in Mixed Tin-Lead Halide Perovskites: Machine Learning Combined with Nonadiabatic Molecular Dynamics.

The findings reveal that Sn oxidation is governed by carrier–lattice coupling through its control over the kinetic accessibility of Sn-centered hole localization, and they identify the suppression of VSn defects and the stabilization of I-rich surface terminations as key design principles for stable Sn–Pb perovskites.

Hao-Ran Lu, Kong Meng, Xu-Hui Xu et al. · 0 citations

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