Pb–Sb合金在液态下的温度相关混合行为

IF 1.4 Q4 MATERIALS SCIENCE, MULTIDISCIPLINARY International Journal of Computational Materials Science and Engineering Pub Date : 2021-08-04 DOI:10.1142/s2047684121500184
I. Bhandari, N. Panthi, I. Koirala
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引用次数: 0

摘要

我们扩展了一个用于研究二元液体合金热力学性质的计算模型,以研究化学短程有序参数和扩散系数。许多模拟也被用于表面性质,例如表面浓度和表面张力。随着温度的升高,还观察到Pb–Sb合金的相分离倾向。使用适用于混合自由能和混合焓的相同相互作用参数测量合金的结构和热力学性能。发现相互作用参数与温度有关,但与浓度无关。我们的结果表明,液态合金Pb–Sb具有弱相互作用成分。根据表面性质综述,具有比其体浓度更高的表面浓度的元素Sb在合金表面上偏析。
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Temperature-dependent mixing behavior of Pb–Sb alloys in liquid state
We have extended a computational model used to research the thermodynamic properties of binary liquid alloys to study chemical short-range order parameters and diffusion coefficients. Numerous simulations have also been employed for surface properties such as surface concentration and surface tension. The propensities for phase separation of the Pb–Sb alloy were also observed with a temperature rise. The structural and thermodynamic properties of the alloys were measured using the same interaction parameters that are suitable for the free energy of mixing and mixing enthalpy. The interaction parameters are discovered to be temperature-dependent but concentration-independent. Our results indicate that the liquid alloy Pb–Sb has a weakly interacting composition. According to the surface property review, the element Sb having a higher surface concentration than its bulk concentration segregates over the surface of the alloy.
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来源期刊
CiteScore
2.10
自引率
15.40%
发文量
27
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