Influence of point defects on grain boundary mobility in bcc tungsten

被引:27
作者
Borovikov, Valery [1 ]
Tang, Xian-Zhu [1 ]
Perez, Danny [1 ]
Bai, Xian-Ming [2 ]
Uberuaga, Blas P. [3 ]
Voter, Arthur F. [1 ]
机构
[1] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA
[2] Idaho Natl Lab, Ctr Adv Modeling & Simulat, Idaho Falls, ID 83415 USA
[3] Los Alamos Natl Lab, Div Mat Sci & Technol, Los Alamos, NM 87545 USA
基金
美国能源部;
关键词
NANOCRYSTALLINE MATERIALS; ATOMISTIC SIMULATION; METALS; DISLOCATIONS; DEFORMATION; ALUMINUM; MOTION; DAMAGE; ITER; FCC;
D O I
10.1088/0953-8984/25/3/035402
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
Atomistic computer simulations were performed to study the influence of radiation-induced damage on grain boundary (GB) sliding processes in bcc tungsten (W), the divertor material in the ITER tokamak and the leading candidate for the first wall material in future fusion reactors. In particular, we calculated the average sliding-friction force as a function of the number of point defects introduced into the GB for a number of symmetric tilt GBs. In all cases the average sliding-friction force at fixed shear strain rate depends on the number of point defects introduced into the GB, and in many cases introduction of these defects reduces the average sliding-friction force by roughly an order of magnitude. We have also observed that as the number of interstitials in the GB is varied, the direction of the coupled GB motion sometimes reverses, causing the GB to migrate in the opposite direction under the same applied shear stress. This could be important in the microstructural evolution of polycrystalline W under the harsh radiation environment in a fusion reactor, in which high internal stresses are present and frequent collision cascades generate interstitials and vacancies.
引用
收藏
页数:9
相关论文
共 25 条
[1]   Role of atomic structure on grain boundary-defect interactions in Cu [J].
Bai, Xian-Ming ;
Vernon, Louis J. ;
Hoagland, Richard G. ;
Voter, Arthur F. ;
Nastasi, Michael ;
Uberuaga, Blas Pedro .
PHYSICAL REVIEW B, 2012, 85 (21)
[2]   Efficient Annealing of Radiation Damage Near Grain Boundaries via Interstitial Emission [J].
Bai, Xian-Ming ;
Voter, Arthur F. ;
Hoagland, Richard G. ;
Nastasi, Michael ;
Uberuaga, Blas P. .
SCIENCE, 2010, 327 (5973) :1631-1634
[3]   Modelling radiation effects using the ab-initio based tungsten and vanadium potentials (vol 267, pg 3204, 2009) [J].
Bjorkas, C. ;
Nordlund, K. ;
Dudarev, S. .
NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION B-BEAM INTERACTIONS WITH MATERIALS AND ATOMS, 2010, 268 (09) :1529-1529
[4]   Modelling radiation effects using the ab-initio based tungsten and vanadium potentials [J].
Bjorkas, C. ;
Nordlund, K. ;
Dudarev, S. .
NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION B-BEAM INTERACTIONS WITH MATERIALS AND ATOMS, 2009, 267 (18) :3204-3208
[5]   Coupling grain boundary motion to shear deformation [J].
Cahn, John W. ;
Mishin, Yuri ;
Suzuki, Akira .
ACTA MATERIALIA, 2006, 54 (19) :4953-4975
[6]   Grain boundary motion assisted via radiation cascades in bcc Fe [J].
Campana, Carlos ;
Boyle, K. P. ;
Miller, Ronald E. .
PHYSICAL REVIEW B, 2008, 78 (13)
[7]   Multiscale modeling of crowdion and vacancy defects in body-centered-cubic transition metals [J].
Derlet, P. M. ;
Nguyen-Manh, D. ;
Dudarev, S. L. .
PHYSICAL REVIEW B, 2007, 76 (05)
[8]   Strain-driven grain boundary motion in nanocrystalline materials [J].
Farkas, Diana ;
Mohanty, Som ;
Monk, Joshua .
MATERIALS SCIENCE AND ENGINEERING A-STRUCTURAL MATERIALS PROPERTIES MICROSTRUCTURE AND PROCESSING, 2008, 493 (1-2) :33-40
[9]   Steps, dislocations and disconnections as interface defects relating to structure and phase transformations [J].
Hirth, JP ;
Pond, RC .
ACTA MATERIALIA, 1996, 44 (12) :4749-4763
[10]  
Kurtz RJ, 1999, PHILOS MAG A, V79, P665, DOI 10.1080/01418619908210324