AI-Driven Discovery of High-Performance Limhx (M = Sc, Ti; X = 3, 4, 5) Hydrides: A First-Principles İnvestigation Structural, Mechanical, Electronic, Thermophysical, Optical and Hydrogen Storage Properties

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Elsevier Ltd

Erişim Hakkı

info:eu-repo/semantics/closedAccess

Özet

[Not Abstract Available]

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Anahtar Kelimeler

AI-driven materials discovery, Complex metal hydrides, Density functional theory, Hydrogen storage, Lithium scandium hydrides, Lithium titanium hydrides

Kaynak

International Journal of Hydrogen Energy

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Cilt

187

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Yamçıçıer, Ç., Yamçıçıer, S., & Kürkçü, C. (2025). AI-driven discovery of high-performance LiMHx (M= Sc, Ti; x= 3, 4, 5) hydrides: A first-principles investigation structural, mechanical, electronic, thermophysical, optical and hydrogen storage properties. International Journal of Hydrogen Energy, 187, 152097.

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