Spurious forces are a significant challenge for multi-scale methods,e.g.,the coupled atomistic/discrete dislocation(CADD)method.The assumption of isotropic matter in the continuum domain is a critical factor leading t...Spurious forces are a significant challenge for multi-scale methods,e.g.,the coupled atomistic/discrete dislocation(CADD)method.The assumption of isotropic matter in the continuum domain is a critical factor leading to such forces.This study aims to minimize spurious forces,ensuring that atomic dislocations experience more precise forces from the continuum domain.The authors have already implemented this idea using a simplified and unrealistic slipping system.To create a comprehensive and realistic model,this paper considers all possible slip systems in the face center cubic(FCC)lattice structure,and derives the required relationships for the displacement fields.An anisotropic version of the three-dimensional CADD(CADD3D)method is presented,which generates the anisotropic displacement fields for the partial dislocations in all the twelve slip systems of the FCC lattice structure.These displacement fields are tested for the most probable slip systems of aluminum,nickel,and copper with different anisotropic levels.Implementing these anisotropic displacement fields significantly reduces the spurious forces on the slip systems of FCC materials.This improvement is particularly pronounced at greater distances from the interface and in more anisotropic materials.Furthermore,the anisotropic CADD3D method enhances the spurious stress difference between the slip systems,particularly for materials with higher anisotropy.展开更多
Stacking faults(SFs)and the interaction between solute atoms and SFs in a Mg–Bi alloy are investigated using aberration-corrected scanning transmission electron microscopy.It is found that abundant I_(1)SFs are gener...Stacking faults(SFs)and the interaction between solute atoms and SFs in a Mg–Bi alloy are investigated using aberration-corrected scanning transmission electron microscopy.It is found that abundant I_(1)SFs are generated after cold rolling and are mainly distributed inside{1012}twins.After aging treatment,the formation of single-layer and three-layer Bi atom segregation in the vicinity of I_(1)fault are clearly observed.Bi segregation also occurs at the 1/6<2203>bounding Frank partial dislocation cores.The segregation behaviors in I_(1)fault and Frank dislocations are discussed and rationalized using first-principles calculations.展开更多
This paper derives the explicit expressions for the average intensity, beam width and angular spread of Gaussian Schell-model （GSM） beams with edge dislocation propagating through atmospheric turbulence along a slan...This paper derives the explicit expressions for the average intensity, beam width and angular spread of Gaussian Schell-model （GSM） beams with edge dislocation propagating through atmospheric turbulence along a slant path. The propagation of GSM beams with edge dislocation through horizontal atmospheric turbulence can be treated as a special case through a slant one. The propagation properties of GSM beams with edge dislocation through slant atmospheric turbulence are studied, where the influence of edge dislocation parameters including the slope p and off-axis distance d on the spreading of GSM beams with edge dislocation in atmospheric turbulence is stressed. It shows that the spreading of the intensity profile of GSM beams with edge dislocation along a slant path is smaller than that along a horizontal path in the long-distance atmospheric propagation. The larger the slope ｜p｜ and the smaller the off-axis distance ｜d｜ are, the less the beam-width spreading and angular spread of GSM beams with edge dislocation are affected by turbulence. The CSM beams with edge dislocation is less affected by turbulence than that of GSM beams without edge dislocation. The results are illustrated numerically and their validity is interpreted physically.展开更多
The mechanism of low-temperature deformation in a fracture process of Ll2 Ni3Al is studied by molecular dynamic simulations. Owing to the unstable stacking energy, the [011] superdislocation is dissociated into partia...The mechanism of low-temperature deformation in a fracture process of Ll2 Ni3Al is studied by molecular dynamic simulations. Owing to the unstable stacking energy, the [011] superdislocation is dissociated into partial dislocations separated by a stacking fault. The simulation results show that when the crack speed is larger than a critical speed, the Shockley partial dislocations will break forth from both the crack tip and the vicinity of the crack tip; subsequently the super intrinsic stacking faults are formed in adjacent {111} planes, meanwhile the super extrinsic stacking faults and twinning also occur. Our simulation results suggest that at low temperatures the ductile fracture in Ll2 Ni3Al is accompanied by twinning, which is produced by super-intrinsic stacking faults formed in adjacent {111} planes.展开更多
文摘Spurious forces are a significant challenge for multi-scale methods,e.g.,the coupled atomistic/discrete dislocation(CADD)method.The assumption of isotropic matter in the continuum domain is a critical factor leading to such forces.This study aims to minimize spurious forces,ensuring that atomic dislocations experience more precise forces from the continuum domain.The authors have already implemented this idea using a simplified and unrealistic slipping system.To create a comprehensive and realistic model,this paper considers all possible slip systems in the face center cubic(FCC)lattice structure,and derives the required relationships for the displacement fields.An anisotropic version of the three-dimensional CADD(CADD3D)method is presented,which generates the anisotropic displacement fields for the partial dislocations in all the twelve slip systems of the FCC lattice structure.These displacement fields are tested for the most probable slip systems of aluminum,nickel,and copper with different anisotropic levels.Implementing these anisotropic displacement fields significantly reduces the spurious forces on the slip systems of FCC materials.This improvement is particularly pronounced at greater distances from the interface and in more anisotropic materials.Furthermore,the anisotropic CADD3D method enhances the spurious stress difference between the slip systems,particularly for materials with higher anisotropy.
基金support by the National Natural Science Foundation of China(52071033)Open Foundation of State Key Laboratory of Advanced Design and Manufacturing for Vehicle Body(32115016).
文摘Stacking faults(SFs)and the interaction between solute atoms and SFs in a Mg–Bi alloy are investigated using aberration-corrected scanning transmission electron microscopy.It is found that abundant I_(1)SFs are generated after cold rolling and are mainly distributed inside{1012}twins.After aging treatment,the formation of single-layer and three-layer Bi atom segregation in the vicinity of I_(1)fault are clearly observed.Bi segregation also occurs at the 1/6<2203>bounding Frank partial dislocation cores.The segregation behaviors in I_(1)fault and Frank dislocations are discussed and rationalized using first-principles calculations.
基金supported by the National Natural Science Foundation of China (Grant No.10874125)
文摘This paper derives the explicit expressions for the average intensity, beam width and angular spread of Gaussian Schell-model （GSM） beams with edge dislocation propagating through atmospheric turbulence along a slant path. The propagation of GSM beams with edge dislocation through horizontal atmospheric turbulence can be treated as a special case through a slant one. The propagation properties of GSM beams with edge dislocation through slant atmospheric turbulence are studied, where the influence of edge dislocation parameters including the slope p and off-axis distance d on the spreading of GSM beams with edge dislocation in atmospheric turbulence is stressed. It shows that the spreading of the intensity profile of GSM beams with edge dislocation along a slant path is smaller than that along a horizontal path in the long-distance atmospheric propagation. The larger the slope ｜p｜ and the smaller the off-axis distance ｜d｜ are, the less the beam-width spreading and angular spread of GSM beams with edge dislocation are affected by turbulence. The CSM beams with edge dislocation is less affected by turbulence than that of GSM beams without edge dislocation. The results are illustrated numerically and their validity is interpreted physically.
基金Project supported by the National Basic Research Program of China (Grant No 2006CB605102)the National Natural Science Foundation of China (Grant No 90306016)
文摘The mechanism of low-temperature deformation in a fracture process of Ll2 Ni3Al is studied by molecular dynamic simulations. Owing to the unstable stacking energy, the [011] superdislocation is dissociated into partial dislocations separated by a stacking fault. The simulation results show that when the crack speed is larger than a critical speed, the Shockley partial dislocations will break forth from both the crack tip and the vicinity of the crack tip; subsequently the super intrinsic stacking faults are formed in adjacent {111} planes, meanwhile the super extrinsic stacking faults and twinning also occur. Our simulation results suggest that at low temperatures the ductile fracture in Ll2 Ni3Al is accompanied by twinning, which is produced by super-intrinsic stacking faults formed in adjacent {111} planes.
