Yu-Sheng Lu , Jia-Yuan Chen , Thi-Xuyen Bui , Ming-Hong Lin , Te-Hua Fang
{"title":"原位压缩与原子模拟研究FeCoNiCr合金的变形与力学特性","authors":"Yu-Sheng Lu , Jia-Yuan Chen , Thi-Xuyen Bui , Ming-Hong Lin , Te-Hua Fang","doi":"10.1016/j.matchar.2025.115024","DOIUrl":null,"url":null,"abstract":"<div><div>In this study, the FeCoNiCr high-entropy alloy (HEA) with (2 0 0) lattice orientations is manufactured <em>via</em> vacuum arc melting (VAM). The mechanical response of FeCoNiCr HEA is measured using dynamic compression, nanoindentation, and scratching tests, both experimentally and through simulation methods. The effect of microstructure on the mechanical properties of compressed FeCoNiCr HEA pillars was further investigated using Molecular dynamics (MD) simulations. The experimental results showed that the FeCoNiCr HEA micropillars under a 50 <em>μ</em>N loading exhibit more considerable strain energies and compressive displacements than those under a 10 <em>μ</em>N loading. The FeCoNiCr HEA micropillar can withstand a 10 <em>μ</em>N cyclic loading without significant damage but develops a clear concave fold at 250 <em>μ</em>N loading. The hardness measured by nanoindentation was 5.74 GPa. Moreover, the elastic modulus of FeCoNiCr HEA, measured by nanoindentation and <em>in-situ</em> TEM, was 44.36 and 2.85 GPa, respectively, exhibiting a lower elastic modulus than the (1 1 1) lattice orientations. The <em>H</em>/<em>E</em> values for the experimental and MD simulations are calculated to be 0.13 and 0.14, respectively, demonstrating their similarity. The simulation results show that the elastic modulus, ultimate compressive strength, and dislocation density decrease with increasing the aspect ratio. The dislocation distribution with an aspect ratio of 1.5 increases after overcoming the ultimate compression strength. The stacking faults and shear bands are concentrated at the top side grain of the nanopillar, leading the atoms to slip along the grain boundaries.</div></div>","PeriodicalId":18727,"journal":{"name":"Materials Characterization","volume":"224 ","pages":"Article 115024"},"PeriodicalIF":4.8000,"publicationDate":"2025-04-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Deformation and mechanical characteristic of FeCoNiCr alloy using in-situ compression and atomic simulation\",\"authors\":\"Yu-Sheng Lu , Jia-Yuan Chen , Thi-Xuyen Bui , Ming-Hong Lin , Te-Hua Fang\",\"doi\":\"10.1016/j.matchar.2025.115024\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><div>In this study, the FeCoNiCr high-entropy alloy (HEA) with (2 0 0) lattice orientations is manufactured <em>via</em> vacuum arc melting (VAM). The mechanical response of FeCoNiCr HEA is measured using dynamic compression, nanoindentation, and scratching tests, both experimentally and through simulation methods. The effect of microstructure on the mechanical properties of compressed FeCoNiCr HEA pillars was further investigated using Molecular dynamics (MD) simulations. The experimental results showed that the FeCoNiCr HEA micropillars under a 50 <em>μ</em>N loading exhibit more considerable strain energies and compressive displacements than those under a 10 <em>μ</em>N loading. The FeCoNiCr HEA micropillar can withstand a 10 <em>μ</em>N cyclic loading without significant damage but develops a clear concave fold at 250 <em>μ</em>N loading. The hardness measured by nanoindentation was 5.74 GPa. Moreover, the elastic modulus of FeCoNiCr HEA, measured by nanoindentation and <em>in-situ</em> TEM, was 44.36 and 2.85 GPa, respectively, exhibiting a lower elastic modulus than the (1 1 1) lattice orientations. The <em>H</em>/<em>E</em> values for the experimental and MD simulations are calculated to be 0.13 and 0.14, respectively, demonstrating their similarity. The simulation results show that the elastic modulus, ultimate compressive strength, and dislocation density decrease with increasing the aspect ratio. The dislocation distribution with an aspect ratio of 1.5 increases after overcoming the ultimate compression strength. The stacking faults and shear bands are concentrated at the top side grain of the nanopillar, leading the atoms to slip along the grain boundaries.</div></div>\",\"PeriodicalId\":18727,\"journal\":{\"name\":\"Materials Characterization\",\"volume\":\"224 \",\"pages\":\"Article 115024\"},\"PeriodicalIF\":4.8000,\"publicationDate\":\"2025-04-14\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Materials Characterization\",\"FirstCategoryId\":\"88\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S1044580325003134\",\"RegionNum\":2,\"RegionCategory\":\"材料科学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q1\",\"JCRName\":\"MATERIALS SCIENCE, CHARACTERIZATION & TESTING\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Materials Characterization","FirstCategoryId":"88","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S1044580325003134","RegionNum":2,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q1","JCRName":"MATERIALS SCIENCE, CHARACTERIZATION & TESTING","Score":null,"Total":0}
Deformation and mechanical characteristic of FeCoNiCr alloy using in-situ compression and atomic simulation
In this study, the FeCoNiCr high-entropy alloy (HEA) with (2 0 0) lattice orientations is manufactured via vacuum arc melting (VAM). The mechanical response of FeCoNiCr HEA is measured using dynamic compression, nanoindentation, and scratching tests, both experimentally and through simulation methods. The effect of microstructure on the mechanical properties of compressed FeCoNiCr HEA pillars was further investigated using Molecular dynamics (MD) simulations. The experimental results showed that the FeCoNiCr HEA micropillars under a 50 μN loading exhibit more considerable strain energies and compressive displacements than those under a 10 μN loading. The FeCoNiCr HEA micropillar can withstand a 10 μN cyclic loading without significant damage but develops a clear concave fold at 250 μN loading. The hardness measured by nanoindentation was 5.74 GPa. Moreover, the elastic modulus of FeCoNiCr HEA, measured by nanoindentation and in-situ TEM, was 44.36 and 2.85 GPa, respectively, exhibiting a lower elastic modulus than the (1 1 1) lattice orientations. The H/E values for the experimental and MD simulations are calculated to be 0.13 and 0.14, respectively, demonstrating their similarity. The simulation results show that the elastic modulus, ultimate compressive strength, and dislocation density decrease with increasing the aspect ratio. The dislocation distribution with an aspect ratio of 1.5 increases after overcoming the ultimate compression strength. The stacking faults and shear bands are concentrated at the top side grain of the nanopillar, leading the atoms to slip along the grain boundaries.
期刊介绍:
Materials Characterization features original articles and state-of-the-art reviews on theoretical and practical aspects of the structure and behaviour of materials.
The Journal focuses on all characterization techniques, including all forms of microscopy (light, electron, acoustic, etc.,) and analysis (especially microanalysis and surface analytical techniques). Developments in both this wide range of techniques and their application to the quantification of the microstructure of materials are essential facets of the Journal.
The Journal provides the Materials Scientist/Engineer with up-to-date information on many types of materials with an underlying theme of explaining the behavior of materials using novel approaches. Materials covered by the journal include:
Metals & Alloys
Ceramics
Nanomaterials
Biomedical materials
Optical materials
Composites
Natural Materials.