运用Miedema混合焓模型计算了Al-Er、Si-Er和Al-Si二元合金的部分热力学性质,选择Er为非对称性组元,在此基础上结合Toop模型计算出Al-Si-Er三元合金的混合焓、过剩熵与过剩自由能.结果表明,Al-Si-Er三元合金的混合焓、过剩熵与过剩自由能在整个浓度范围内均为负值,在富Er和贫Er区域各热力学参数变化趋势较大.通过计算Al、Si和Er 3种组元的偏摩尔过剩自由能得到Al-Si-Er三元合金各组元的等活度值曲线.曲线显示各组元随着摩尔分数的减少其活度值都急剧减小,在三元系成分三角形的中心部分Al,Si和Er的活度值都很小,这表明Al、Si和Er 3种组元之间存在很强的相互作用,易形成三元金属间化合物,这一结论与Al-Si-Er三元相图的实际情况相符合.
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