The mechanical response of a single crystal titanium sample against(0001)α surface impact was investigated using molecular dynamics simulation.Remarkably,non-uniform plastic deformation was observed in the sample.At ...The mechanical response of a single crystal titanium sample against(0001)α surface impact was investigated using molecular dynamics simulation.Remarkably,non-uniform plastic deformation was observed in the sample.At high strain rates,amorphization occurred near the edge of the contact region where severe shear strain induced a large number of stacking faults(SFs)and dislocations.In contrast,the central part of the contact region underwent less deformation with significantly fewer dislocations.Moreover,instead of amorphization by consuming SFs and dislocations,there was a gradual increase in the density of dislocations and SFs during the process of amorphization.These local amorphous regions eventually grew into shear bands.展开更多
The interaction between{112}<111>deformation twinning and grain boundary in coaxial polycrystalline tantalum under shock compression was studied with molecular dynamics simulation under different grain pair miso...The interaction between{112}<111>deformation twinning and grain boundary in coaxial polycrystalline tantalum under shock compression was studied with molecular dynamics simulation under different grain pair misorientation angles(MA)and geometric compatibility factor(m’).Generally,in the coaxial polycrystal,the value of MA determines the occurrence of twin transfer(TT)or twin blockage(TB),i.e.,twin transfer occurs at MA≤29°with twin blockage otherwise.Under TT,the value of m’affects the selection of twin variants.,i.e.,the twin system with a larger m’is easier to active.The morphology of twin pairs is ruler-shaped and lenticular under TT and TB,respectively,with different thickening mechanisms,including grain boundary dislocation emission.展开更多
基金the National Natural Science Foundation of China(U2241245,91960202 and 52271012)the National Key Laboratory Foundation of Science and Technology on Materials under Shock and Impact(6142902220301)+2 种基金the Aeronautical Science Foundation of China(2022Z053092001)the Shanghai Engineering Research Center of High-Performance Medical Device Materials(20DZ2255500)the Opening Project of National Key Laboratory of Shock Wave and Detonation Physics(2022JCJQLB05702).
文摘The mechanical response of a single crystal titanium sample against(0001)α surface impact was investigated using molecular dynamics simulation.Remarkably,non-uniform plastic deformation was observed in the sample.At high strain rates,amorphization occurred near the edge of the contact region where severe shear strain induced a large number of stacking faults(SFs)and dislocations.In contrast,the central part of the contact region underwent less deformation with significantly fewer dislocations.Moreover,instead of amorphization by consuming SFs and dislocations,there was a gradual increase in the density of dislocations and SFs during the process of amorphization.These local amorphous regions eventually grew into shear bands.
基金financially supported by the Key-Area Re-search and Development Program of GuangDong Province(No.2019B010941001)National Key Laboratory Foundation of Science and Technology on Materials under Shock and Impact(No.6142902220301)+1 种基金Shanghai Engineering Research Center of High-Performance Medical Device Materials(No.20DZ2255500)the Major Science and Technology Infrastructure Project of Material Genome Bigscience Facilities Platform supported by Municipal Development and Reform Commission of Shenzhen.
文摘The interaction between{112}<111>deformation twinning and grain boundary in coaxial polycrystalline tantalum under shock compression was studied with molecular dynamics simulation under different grain pair misorientation angles(MA)and geometric compatibility factor(m’).Generally,in the coaxial polycrystal,the value of MA determines the occurrence of twin transfer(TT)or twin blockage(TB),i.e.,twin transfer occurs at MA≤29°with twin blockage otherwise.Under TT,the value of m’affects the selection of twin variants.,i.e.,the twin system with a larger m’is easier to active.The morphology of twin pairs is ruler-shaped and lenticular under TT and TB,respectively,with different thickening mechanisms,including grain boundary dislocation emission.
