Yun-Li Li , Wen-Ping Wu , Daniel Şopu , Jürgen Eckert
{"title":"冲击诱导的 Cu/Cu64Zr36 结晶/非晶态复合材料塑性变形和剥落行为的分子动力学模拟","authors":"Yun-Li Li , Wen-Ping Wu , Daniel Şopu , Jürgen Eckert","doi":"10.1016/j.jnoncrysol.2024.123300","DOIUrl":null,"url":null,"abstract":"<div><div>Molecular dynamics (MD) simulations were performed to study the shock-induced plastic deformation and spallation failure of Cu/Cu<sub>64</sub>Zr<sub>36</sub> crystalline/amorphous composites with a pre-existing void. The results show that the pre-existing void collapses always perpendicular to the direction of the shock loading, regardless of whether the shock direction starts from the crystalline phase or the amorphous phase. The Cu/Cu<sub>64</sub>Zr<sub>36</sub> composites are more prone to spallation failure when the shock starts from the Cu crystalline phase. The changes of dislocation density and shear transformation zone (STZ) activation are closely related to the magnitude and direction of shock velocity. When the shock velocity reaches 2.0 km/s, dislocations in the crystalline phase disappear, dislocation density is close to zero and STZs activate throughout the entire amorphous phase. In addition, regardless of the shock velocity and direction, no shear bands are generated in the Cu/Cu<sub>64</sub>Zr<sub>36</sub> composites under shock loading, which is significantly different from the case of tensile loading.</div></div>","PeriodicalId":16461,"journal":{"name":"Journal of Non-crystalline Solids","volume":"647 ","pages":"Article 123300"},"PeriodicalIF":3.2000,"publicationDate":"2024-11-02","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Molecular dynamics simulation of shock-induced plastic deformation and spallation behavior of Cu/Cu64Zr36 crystalline/amorphous composites\",\"authors\":\"Yun-Li Li , Wen-Ping Wu , Daniel Şopu , Jürgen Eckert\",\"doi\":\"10.1016/j.jnoncrysol.2024.123300\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><div>Molecular dynamics (MD) simulations were performed to study the shock-induced plastic deformation and spallation failure of Cu/Cu<sub>64</sub>Zr<sub>36</sub> crystalline/amorphous composites with a pre-existing void. The results show that the pre-existing void collapses always perpendicular to the direction of the shock loading, regardless of whether the shock direction starts from the crystalline phase or the amorphous phase. The Cu/Cu<sub>64</sub>Zr<sub>36</sub> composites are more prone to spallation failure when the shock starts from the Cu crystalline phase. The changes of dislocation density and shear transformation zone (STZ) activation are closely related to the magnitude and direction of shock velocity. When the shock velocity reaches 2.0 km/s, dislocations in the crystalline phase disappear, dislocation density is close to zero and STZs activate throughout the entire amorphous phase. In addition, regardless of the shock velocity and direction, no shear bands are generated in the Cu/Cu<sub>64</sub>Zr<sub>36</sub> composites under shock loading, which is significantly different from the case of tensile loading.</div></div>\",\"PeriodicalId\":16461,\"journal\":{\"name\":\"Journal of Non-crystalline Solids\",\"volume\":\"647 \",\"pages\":\"Article 123300\"},\"PeriodicalIF\":3.2000,\"publicationDate\":\"2024-11-02\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Journal of Non-crystalline Solids\",\"FirstCategoryId\":\"88\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S0022309324004769\",\"RegionNum\":3,\"RegionCategory\":\"材料科学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q1\",\"JCRName\":\"MATERIALS SCIENCE, CERAMICS\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Non-crystalline Solids","FirstCategoryId":"88","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0022309324004769","RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q1","JCRName":"MATERIALS SCIENCE, CERAMICS","Score":null,"Total":0}
Molecular dynamics simulation of shock-induced plastic deformation and spallation behavior of Cu/Cu64Zr36 crystalline/amorphous composites
Molecular dynamics (MD) simulations were performed to study the shock-induced plastic deformation and spallation failure of Cu/Cu64Zr36 crystalline/amorphous composites with a pre-existing void. The results show that the pre-existing void collapses always perpendicular to the direction of the shock loading, regardless of whether the shock direction starts from the crystalline phase or the amorphous phase. The Cu/Cu64Zr36 composites are more prone to spallation failure when the shock starts from the Cu crystalline phase. The changes of dislocation density and shear transformation zone (STZ) activation are closely related to the magnitude and direction of shock velocity. When the shock velocity reaches 2.0 km/s, dislocations in the crystalline phase disappear, dislocation density is close to zero and STZs activate throughout the entire amorphous phase. In addition, regardless of the shock velocity and direction, no shear bands are generated in the Cu/Cu64Zr36 composites under shock loading, which is significantly different from the case of tensile loading.
期刊介绍:
The Journal of Non-Crystalline Solids publishes review articles, research papers, and Letters to the Editor on amorphous and glassy materials, including inorganic, organic, polymeric, hybrid and metallic systems. Papers on partially glassy materials, such as glass-ceramics and glass-matrix composites, and papers involving the liquid state are also included in so far as the properties of the liquid are relevant for the formation of the solid.
In all cases the papers must demonstrate both novelty and importance to the field, by way of significant advances in understanding or application of non-crystalline solids; in the case of Letters, a compelling case must also be made for expedited handling.