An Overview of Recent Standard and Accelerated Molecular Dynamics Simulations of Helium Behavior in Tungsten

被引:10
作者
Sandoval, Luis [1 ]
Perez, Danny [1 ]
Uberuaga, Blas P. [2 ]
Voter, Arthur E. [1 ]
机构
[1] Los Alamos Natl Lab, Theoret Div T 1, Los Alamos, NM 87545 USA
[2] Los Alamos Natl Lab, Mat Sci & Technol Div MST 8, Los Alamos, NM 87545 USA
关键词
helium bubbles; tungsten; nucleation and growth; LOW-ENERGY HELIUM; MONTE-CARLO SIMULATIONS; DISLOCATION LOOP; GRAIN-BOUNDARY; CLUSTERS; BOMBARDMENTS; POTENTIALS; RETENTION; BUBBLES;
D O I
10.3390/ma12162500
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
One of the most critical challenges for the successful adoption of nuclear fusion power corresponds to plasma-facing materials. Due to its favorable properties in this context (low sputtering yield, high thermal conductivity, high melting point, among others), tungsten is a leading candidate material. Nevertheless, tungsten is affected by the plasma and fusion byproducts. Irradiation by helium nuclei, in particular, strongly modifies the surface structure by a synergy of processes, whose origin is the nucleation and growth of helium bubbles. In this review, we present recent advances in the understanding of helium effects in tungsten from a simulational approach based on accelerated molecular dynamics, which emphasizes the use of realistic parameters, as are expected in experimental and operational fusion power conditions.
引用
收藏
页数:19
相关论文
共 53 条
[41]   Temperature-accelerated dynamics for simulation of infrequent events [J].
Sorensen, MR ;
Voter, AF .
JOURNAL OF CHEMICAL PHYSICS, 2000, 112 (21) :9599-9606
[43]   Temperature dependence of underdense nanostructure formation in tungsten under helium irradiation [J].
Valles, G. ;
Martin-Bragado, I. ;
Nordlund, K. ;
Lasa, A. ;
Bjorkas, C. ;
Safi, E. ;
Perlado, J. M. ;
Rivera, A. .
JOURNAL OF NUCLEAR MATERIALS, 2017, 490 :108-114
[44]   The influence of high grain boundary density on helium retention in tungsten [J].
Valles, G. ;
Gonzalez, C. ;
Martin-Bragado, I. ;
Iglesias, R. ;
Perlado, J. M. ;
Rivera, A. .
JOURNAL OF NUCLEAR MATERIALS, 2015, 457 :80-87
[45]   VACANCY CREATION BY HELIUM TRAPPING AT SUBSTITUTIONAL KRYPTON IN TUNGSTEN [J].
VANVEEN, A ;
CASPERS, LM ;
KORNELSEN, EV ;
FASTENAU, R ;
VANGORKUM, A ;
WARNAAR, A .
PHYSICA STATUS SOLIDI A-APPLIED RESEARCH, 1977, 40 (01) :235-246
[46]   Parallel replica method for dynamics of infrequent events [J].
Voter, AF .
PHYSICAL REVIEW B, 1998, 57 (22) :13985-13988
[47]   Energetics of small helium clusters near tungsten surface by ab initio calculations [J].
Wan, ChuBin ;
Yu, SuYe ;
Ju, Xin .
JOURNAL OF NUCLEAR MATERIALS, 2018, 499 :539-545
[48]   Energetics and kinetics unveiled on helium cluster growth in tungsten [J].
Wang, Jinlong ;
Niu, Liang-Liang ;
Shu, Xiaolin ;
Zhang, Ying .
NUCLEAR FUSION, 2015, 55 (09)
[49]   SELF-TRAPPING OF HELIUM IN METALS [J].
WILSON, WD ;
BISSON, CL ;
BASKES, MI .
PHYSICAL REVIEW B, 1981, 24 (10) :5616-5624
[50]   A new loop-punching mechanism for helium bubble growth in tungsten [J].
Xie, Hongxian ;
Gao, Ning ;
Xu, Ke ;
Lu, Guang-Hong ;
Yu, Tao ;
Yin, Fuxing .
ACTA MATERIALIA, 2017, 141 :10-17