摘要
Twinning is a deformation mechanism that creates three-dimensional(3D)twin domains through the migration of twin facets.This occurs via the nucleation and glide of twinning disconnections(TDs),which can pile up to create twin facets.A comprehensive under-standing of twin facets associated with 3D twins,including their atomic structures and energies,is crucial for understanding deformation twinning.In this study,we propose a molecular statics/dynamics(MS/MD)approach to determine characteristic twin facets enclosing 3D non-equilibrium/equilibrium{1011}twin domains,which has been much less studied than the counterpart{1012}twin domains.The stability of different TD pile-up arrangement with varying line senses informs the morphology of 3D non-equilibrium twins,which are bounded by{1010}_(T)||{1013}_(M),{1011}_(T)||{0002}_(M)and{1013}_(T)||{1013}_(M)coherent facets associated with pile-up of edge TDs,and discrete non-edge TDs aligned along CTBs with their line senses parallel to<4513>,<1101>,<5416><2113>or<1012>axes.Formation of semi-coherent facets of equilibrium twins is accompanied by rearrangement of TDs around misfit dislocations.3D equilibrium{1011}twins may comprise{1011}_(T)||{0002}_(M),{1457}_(T)||{3419}_(M),{1657}_(T)||{5617}_(M),{1433}_(T)||{3413}_(M),{0110}_(T)||{0111}_(M)and{0221}_(T)||{0221}_(M)semi-coherent facets in<1210>,<4513>,<1101>,<5416>,<2113>and<1012>axes,respectively.
基金
supports by the National Key R&D Program of China(No.2022YFB3708900).
