Effect of P impurity on NiAlΣ5 grain boundary from first-principles study
(color online) Charge density difference between the cases of S4 and I8. Yellow area represents the charge accumulation and the green parts indicate the charge depletion.
Effect of P impurity on NiAlΣ5 grain boundary from first-principles study |
|
(color online) Charge density difference between the cases of S4 and I8. Yellow area represents the charge accumulation and the green parts indicate the charge depletion. |
| |