Zi-Shan Luo

Small-sample ensemble learning-driven prediction and mechanistic analysis of hydrogen release performance in modified LiBH 4

To address the complexity and high cost of traditional approaches for metal-modified LiBH4 systems, this study proposes a small-sample ensemble learning-density functional theory (EL-DFT) framework for the efficient prediction and mechanistic analysis of hydrogen dissociation energies ( E d ) in bimetal-doped stru...