Atomistic simulation of interaction of collision cascade with different types of grain boundaries in α-Fe

2019 ◽  
Vol 523 ◽  
pp. 444-457 ◽  
Author(s):  
A. Kedharnath ◽  
Rajeev Kapoor ◽  
Apu Sarkar
2002 ◽  
Vol 751 ◽  
Author(s):  
John H. Harding ◽  
Dorothy M. Duffy ◽  
Duncan J. Harris

ABSTRACTInterfaces can be considered at a variety of length scales. All interfaces except grain boundaries are dielectric interfaces. In many cases, the geometric constraints of matching two lattices must be considered, together with the misfit strains that are often present. Continuum mechanics is useful for tackling such problems. In many cases, however, the local ordering of ions must also be considered. Atomistic simulation is therefore necessary, together with the problems associated with large length scales and long time scales. We discuss a number of examples to illustrate the issues involved and the compromises between different approaches that must be made.


2003 ◽  
Vol 18 (5) ◽  
pp. 1031-1034 ◽  
Author(s):  
Z. F. Zhang ◽  
Z. G. Wang ◽  
J. Eckert

Three typical interactions of persistent slip bands (PSBs) with different types of grain boundaries (GBs) were investigated and analyzed in fatigued copper crystals. The results show that PSBs cannot transfer through all types of large-angle GBs, regardless of their orientation with respect to the stress axis. Secondary slip was often observed near the GBs, leading to strain incompatibility. When the slip systems of the two adjacent crystals are coplanar, the transmission of a PSB across a GB strongly depends on the slip directions of the two adjacent crystals. It was found that only the low-angle GBs can be passed through by PSBs, and accordingly they are insensitive to intergranular fatigue cracking. For a special copper bicrystal with coplanar slip systems, the ladderlike dislocation arrangements within the adjacent PSBs become discontinuous and a dislocation-affected-zone appears near the GB due to the difference in the slip direction of the two adjacent crystals. Therefore, the necessary conditions for the transmission of a PSB across a GB are that the neighboring grains have a coplanar slip system and identical slip directions.


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