Ab initio study of the distribution of point defects at grain boundaries in crystalline silicon

JETP Letters ◽  
2013 ◽  
Vol 98 (2) ◽  
pp. 76-79 ◽  
Author(s):  
V. Yu. Lazebnykh ◽  
A. S. Mysovsky
Keyword(s):  
Ab Initio ◽  
Grain Boundaries ◽  
Point Defects ◽  
Crystalline Silicon ◽  
Ab Initio Study

Point defects at the Σ5(012)[100] grain boundary in TiN and the early stages of Cu diffusion: An ab initio study

2018 ◽  
Vol 144 ◽  
pp. 496-504 ◽  
Author(s):  
Maxim N. Popov ◽  
Anton S. Bochkarev ◽  
Vsevolod I. Razumovskiy ◽  
Peter Puschnig ◽  
Jürgen Spitaler
Keyword(s):  
Grain Boundary ◽  
Ab Initio ◽  
Point Defects ◽  
Ab Initio Study ◽  
Early Stages

scholarly journals Ab initio study of the stability of intrinsic and extrinsic Ag point defects in 3C SiC

2018 ◽  
Vol 510 ◽  
pp. 596-602 ◽  
Author(s):  
Nanjun Chen ◽  
Qing Peng ◽  
Zhijie Jiao ◽  
Isabella van Rooyen ◽  
William F. Skerjanc ◽  
...  
Keyword(s):  
Ab Initio ◽  
Point Defects ◽  
Ab Initio Study ◽  
The Stability

Ab Initio Study of Grain Boundaries in SiC and Si

1998 ◽  
Vol 294-296 ◽  
pp. 231-234 ◽  
Author(s):  
Masanori Kohyama ◽  
Kenji Tanaka
Keyword(s):  
Ab Initio ◽  
Grain Boundaries ◽  
Ab Initio Study

Ab initio study of He point defects in fcc Au–Ag alloys

2013 ◽  
Vol 557 ◽  
pp. 5-10 ◽  
Author(s):  
Z.Q. Zhu ◽  
L. Yang ◽  
J.L. Nie ◽  
S.M. Peng ◽  
X.G. Long ◽  
...  
Keyword(s):  
Ab Initio ◽  
Point Defects ◽  
Ab Initio Study

scholarly journals Ab initio study of point defects near stacking faults in 3C-SiC

2016 ◽  
Vol 123 ◽  
pp. 131-138 ◽  
Author(s):  
Jianqi Xi ◽  
Bin Liu ◽  
Yanwen Zhang ◽  
William J. Weber
Keyword(s):  
Ab Initio ◽  
Point Defects ◽  
Stacking Faults ◽  
Ab Initio Study
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