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Ni3Ga中間相結構缺陷的熱力學和統計熱力學分析

Thermodynamics and Statistical-Thermodynamics of the Ni3Ga Intermetallic Compound

  • 摘要: 使用以穩定的ZrO2為電解質的高溫固體電解質電池電動勢方法測量了Ni3Ga非整比金屬間化合物1073至1273K均相范圍內Ga的活度,計算了偏摩爾焓和偏摩爾摘等熱力學性質.考慮4種點缺陷,即分別在2個亞晶格上的反結構原子和空位共存于該Ll2型化合物中,各缺陷生成自由能為可調參數:Ef(Aβ)=0.60eV,Ef(Bα)=0.60eV,EfV(α)=1.5eV,EfV(β)=2.0eV,用統計熱力學方法推導了Ni3Ga非整比化合物均相范圍內缺陷濃度及其與溫度和成分的關系,得到1123K時整比處的無序參數α'=0.0009.

     

    Abstract: Thermodynamic activities of gallium were measured between 1073 and 1273 K in the nonstoichiometric intermetallic compound Ni3Ga using an emf-method based on solid oxygen-conducting electrolytes. The partial molar enthalpies and entropies were derived from their dependence on temperature. The results of the activity measurements were interpreted in terms of a statistical-thermodynamic model for nonstoichiometric phases with the cubic Ll2-superstructure considering four types of point defects, i. e-antistructure atoms and vacancies on the nickel- and gallium-sublattice. The enerpies of formation of the point defects at the stoichiometric composition are used as adjustable parameter.

     

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