Interaction of an edge dislocation with voids in α-iron modelled with different interatomic potentials

被引:103
作者
Terentyev, D. [1 ]
Bacon, D. J. [2 ]
Osetsky, Yu N. [3 ]
机构
[1] CEN SCK, Nucl Mat Sci Inst, B-2400 Mol, Belgium
[2] Univ Liverpool, Dept Engn, Liverpool L69 3GH, Merseyside, England
[3] Oak Ridge Natl Lab, Oak Ridge, TN 37831 USA
基金
英国工程与自然科学研究理事会;
关键词
D O I
10.1088/0953-8984/20/44/445007
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
Atomic processes and strengthening effects due to interaction between edge dislocations and voids in alpha-iron have been investigated by means of molecular dynamics with a recently developed interatomic potential (Ackland et al 2004 J. Phys.: Condens. Matter 16 S2629) and compared with those obtained earlier with an older potential (Ackland et al 1997 Phil. Mag. A 75 713). Differences between the interactions for the two models are insignificant at temperature T >= 100 K, thereby confirming the validity of the previous results. In particular, voids are relatively strong obstacles because for large voids and/or low temperature, the initially straight edge dislocation is pulled into screw orientation before it breaks away at the critical shear stress, tau(c). Differences between the core structures and glide planes of the 1/2 < 111 > screw dislocation for the two potentials do not affect tc in this temperature range. The only significant difference between the dislocation-void interactions in the two models occurs at low temperature in static or pseudo-static conditions (T <= 1 K). It arises from the influence of the dislocation segment in the 70 degrees-mixed orientation with the (Ackland et al 2004 J. Phys.: Condens. Matter 16 S2629) potential and is seen in the critical line shape at which the dislocation breaks from the void. It affects tc for some combinations of void size and spacing. The effect on the line shape does not arise from anisotropy of the elastic line tension: it is due to the high Peierls stress of the 70 degrees dislocation. When this effect does not control breakaway, the dependence of tau(c) on void size and spacing follows an equation first found by modelling the Orowan process in the approximation of linear elasticity.
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页数:11
相关论文
共 35 条
[1]   Computer simulation of point defect properties in dilute Fe-Cu alloy using a many-body interatomic potential [J].
Ackland, GJ ;
Bacon, DJ ;
Calder, AF ;
Harry, T .
PHILOSOPHICAL MAGAZINE A-PHYSICS OF CONDENSED MATTER STRUCTURE DEFECTS AND MECHANICAL PROPERTIES, 1997, 75 (03) :713-732
[2]   Development of an interatomic potential for phosphorus impurities in α-iron [J].
Ackland, GJ ;
Mendelev, MI ;
Srolovitz, DJ ;
Han, S ;
Barashev, AV .
JOURNAL OF PHYSICS-CONDENSED MATTER, 2004, 16 (27) :S2629-S2642
[3]  
Bacon D.J., 1985, FUNDAMENTALS DEFORMA, P401
[4]  
Bacon D.J, 2007, J MET, P42
[5]   Modelling dislocation-obstacle interactions in metals exposed to an irradiation environment [J].
Bacon, DJ ;
Osetsky, YN .
MATERIALS SCIENCE AND ENGINEERING A-STRUCTURAL MATERIALS PROPERTIES MICROSTRUCTURE AND PROCESSING, 2005, 400 :353-361
[6]   EFFECT OF DISLOCATION SELF-INTERACTION ON OROWAN STRESS [J].
BACON, DJ ;
KOCKS, UF ;
SCATTERGOOD, RO .
PHILOSOPHICAL MAGAZINE, 1973, 28 (06) :1241-1263
[7]   COMPILATION OF DISLOCATION ENERGY AND ITS DERIVATIVES IN ANISOTROPIC CRYSTALS [J].
BACON, DJ ;
SCATTERGOOD, RO .
JOURNAL OF PHYSICS F-METAL PHYSICS, 1974, 4 (12) :2126-2137
[8]  
BACON DJ, 2006, PHILOS MAG, V86, P3291
[9]   Nature of defect clusters in neutron-irradiated iron-based alloys deduced from small-angle neutron scattering [J].
Bergner, F. ;
Ulbricht, A. ;
Gokhman, A. ;
Erak, D. .
JOURNAL OF NUCLEAR MATERIALS, 2008, 373 (1-3) :199-205
[10]   The glide of screw dislocations in bcc Fe: Atomistic static and dynamic simulations [J].
Chaussidon, Julien ;
Fivel, Marc ;
Rodney, David .
ACTA MATERIALIA, 2006, 54 (13) :3407-3416