Composition formulas of solid-solution alloys derived from chemical-short-range orders

由化学短程有序结构推导出的固溶体合金的组成式

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Abstract

Solid solutions are the basis for most industrial alloys. However, the relationships between their characteristic short-range orders and chemical compositions have not been established. The present work combines Cowley parameter α with our cluster-plus-glue-atom model to accurately derive the chemical units of binary solid-solution alloys of face-centered cubic type. The chemical unit carries information on atomic structure and chemical composition, which explains prevailing industrial alloys. For example, chemical units in Cu(68.9)Zn(31.1) alloy with α(1) = - 0.137 are formulated as [Zn-Cu(10)Zn(2)]Zn(2)Cu(2) and [Zn-Cu(10)Zn(2)]Zn(3)Cu(1), with 64.0-70.0 wt% Cu corresponding to the most widely used cartridge brass C26000 (68.5-71.5 Cu). This work answers the long-standing question on the composition origin of solid-solution-based industrial alloys, by tracing to the molecule-like chemical units implied in chemical short-range ordering in solid solutions.

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