Influence of C, H, N, and O interstitial atoms on deformation mechanism in titanium—First principles calculations of generalized stacking fault energy

2013 ◽  
Vol 94 ◽  
pp. 92-94 ◽  
Author(s):  
P. Kwasniak ◽  
M. Muzyk ◽  
H. Garbacz ◽  
K.J. Kurzydlowski
Keyword(s):  
Deformation Mechanism ◽  
First Principles ◽  
Stacking Fault ◽  
Stacking Fault Energy ◽  
First Principles Calculations ◽  
Interstitial Atoms ◽  
Generalized Stacking Fault ◽  
Generalized Stacking Fault Energy

scholarly journals Atomic structure, electronic properties and generalized stacking fault energy of diamond/c-BN multilayer

RSC Advances ◽  
2017 ◽  
Vol 7 (47) ◽  
pp. 29599-29605 ◽  
Author(s):  
Zijun Lin ◽  
Xianghe Peng ◽  
Cheng Huang ◽  
Tao Fu ◽  
Zhongchang Wang
Keyword(s):  
Electronic Properties ◽  
Atomic Structure ◽  
First Principles ◽  
Stacking Fault ◽  
Stacking Fault Energy ◽  
First Principles Calculations ◽  
Atomic Structures ◽  
Generalized Stacking Fault ◽  
Stacking Fault Energies ◽  
Generalized Stacking Fault Energy

The atomic structures, electronic properties and generalized stacking fault energies of the diamond/c-BN multilayer are investigated systematically with first-principles calculations.

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