Yiqing Wang, Cai Li, Ye Yuan, Yimao Yu, Kai Wang, Yuan Huang
{"title":"多组分合金热力学计算原理的扩展及其在铬-钼-铌-钒高熵合金热力学性质研究中的应用","authors":"Yiqing Wang, Cai Li, Ye Yuan, Yimao Yu, Kai Wang, Yuan Huang","doi":"10.1016/j.matchemphys.2024.130131","DOIUrl":null,"url":null,"abstract":"<div><div>In this paper, based on the improved Miedema model and the quaternary alloy calculation model expanded by Chou model, the activity calculation model of the ternary alloy system is extended to the quaternary alloy system through the ternary alloy activity calculation model of Wagner and Ma Zhongting et al. In addition, a new deviation function is used in the expanded quaternary alloy calculation model to calculate the thermodynamic properties of quaternary alloys, which meets the characteristics of both non-negativity and reducibility. Using the developed model, this paper calculates the thermodynamic data of each sub-binary, sub-ternary, and quaternary system in the Cr–Mo–Nb–V quaternary high entropy alloy system. Subsequently, this paper analyzes the interactions between components, predicts the possible precipitated phases in the alloy system, and explains the possibility of forming a solid solution in the alloy system. The final results are consistent with those shown in the literatures on studying the Cr–Mo–Nb–V quaternary alloy system, which verifies the applicability of the developed model in the miscible alloy system, enriches the thermodynamic database of Cr–Mo–Nb–V alloy, and provides theoretical reference and ideas for the design of multi-component alloys.</div></div>","PeriodicalId":18227,"journal":{"name":"Materials Chemistry and Physics","volume":"329 ","pages":"Article 130131"},"PeriodicalIF":4.3000,"publicationDate":"2024-11-09","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Expansion of thermodynamic calculation principle of multi-component alloy and its application in the study of thermodynamic properties of the Cr–Mo–Nb–V high entropy alloy\",\"authors\":\"Yiqing Wang, Cai Li, Ye Yuan, Yimao Yu, Kai Wang, Yuan Huang\",\"doi\":\"10.1016/j.matchemphys.2024.130131\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><div>In this paper, based on the improved Miedema model and the quaternary alloy calculation model expanded by Chou model, the activity calculation model of the ternary alloy system is extended to the quaternary alloy system through the ternary alloy activity calculation model of Wagner and Ma Zhongting et al. In addition, a new deviation function is used in the expanded quaternary alloy calculation model to calculate the thermodynamic properties of quaternary alloys, which meets the characteristics of both non-negativity and reducibility. Using the developed model, this paper calculates the thermodynamic data of each sub-binary, sub-ternary, and quaternary system in the Cr–Mo–Nb–V quaternary high entropy alloy system. Subsequently, this paper analyzes the interactions between components, predicts the possible precipitated phases in the alloy system, and explains the possibility of forming a solid solution in the alloy system. The final results are consistent with those shown in the literatures on studying the Cr–Mo–Nb–V quaternary alloy system, which verifies the applicability of the developed model in the miscible alloy system, enriches the thermodynamic database of Cr–Mo–Nb–V alloy, and provides theoretical reference and ideas for the design of multi-component alloys.</div></div>\",\"PeriodicalId\":18227,\"journal\":{\"name\":\"Materials Chemistry and Physics\",\"volume\":\"329 \",\"pages\":\"Article 130131\"},\"PeriodicalIF\":4.3000,\"publicationDate\":\"2024-11-09\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Materials Chemistry and Physics\",\"FirstCategoryId\":\"88\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S0254058424012598\",\"RegionNum\":3,\"RegionCategory\":\"材料科学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q2\",\"JCRName\":\"MATERIALS SCIENCE, MULTIDISCIPLINARY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Materials Chemistry and Physics","FirstCategoryId":"88","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0254058424012598","RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"MATERIALS SCIENCE, MULTIDISCIPLINARY","Score":null,"Total":0}
Expansion of thermodynamic calculation principle of multi-component alloy and its application in the study of thermodynamic properties of the Cr–Mo–Nb–V high entropy alloy
In this paper, based on the improved Miedema model and the quaternary alloy calculation model expanded by Chou model, the activity calculation model of the ternary alloy system is extended to the quaternary alloy system through the ternary alloy activity calculation model of Wagner and Ma Zhongting et al. In addition, a new deviation function is used in the expanded quaternary alloy calculation model to calculate the thermodynamic properties of quaternary alloys, which meets the characteristics of both non-negativity and reducibility. Using the developed model, this paper calculates the thermodynamic data of each sub-binary, sub-ternary, and quaternary system in the Cr–Mo–Nb–V quaternary high entropy alloy system. Subsequently, this paper analyzes the interactions between components, predicts the possible precipitated phases in the alloy system, and explains the possibility of forming a solid solution in the alloy system. The final results are consistent with those shown in the literatures on studying the Cr–Mo–Nb–V quaternary alloy system, which verifies the applicability of the developed model in the miscible alloy system, enriches the thermodynamic database of Cr–Mo–Nb–V alloy, and provides theoretical reference and ideas for the design of multi-component alloys.
期刊介绍:
Materials Chemistry and Physics is devoted to short communications, full-length research papers and feature articles on interrelationships among structure, properties, processing and performance of materials. The Editors welcome manuscripts on thin films, surface and interface science, materials degradation and reliability, metallurgy, semiconductors and optoelectronic materials, fine ceramics, magnetics, superconductors, specialty polymers, nano-materials and composite materials.