Second nearest-neighbor modified embedded-atom method interatomic potentials for the Pd-M (M = Al, Co, Cu, Fe, Mo, Ni, Ti) binary systems

Palladium (Pd) has attracted attention as one of the major components of noble metal catalysts due to its excellent reactivity to a wide range of catalytic reactions. It is important to predict and control the atomic arrangement in catalysts because their properties are known to be affected by it. T...

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Veröffentlicht in:Calphad 2018-09, Vol.62, p.172-186
Hauptverfasser: Jeong, Ga-Un, Park, Chang Seo, Do, Hyeon-Seok, Park, Seul-Mi, Lee, Byeong-Joo
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Sprache:eng
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