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Author

Abdurrouf

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Jul 2026

Machine-learning molecular dynamics and DFT analysis of CoFe2O4 spinel stability and hydrogen recombination energetics for high-temperature thermochemical hydrogen production

ABSTRACT This study examines the structural stability of CoFe2O4 and the energetics of Langmuir–Hinshelwood recombinative desorption of two pre-adsorbed hydrogen atoms on the CoFe2O4 (111) surface, relevant to high-temperature thermochemical hydrogen production. A pretrained universal M3GNet graph neural-network potent...

R. Arifin, Y. Winardi, I. Widaningrum et al. · 0 citations

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