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Abstract:
Although PtAl is an attractive thermal barrier coating (TBC), the key problem is to adjust the correlation between the oxidation resistance and mechanical properties. Here, we apply the first-principle calculations to investigate the oxidation mechanism of PtAl coating and explore the influence of alloying elements(Y, Cr and Si) on the oxidation resistance of PtAl coating. We further study the influence of Cr concentration on the elastic modulus and brittle-or-ductile behavior of PtAl. It is found that 0 prefers to occupy the center of Pt tetrahedron. Compared to Y-dopant, Cr-dopant and Si-dopant enhance the oxidation resistance of PtAl coating because the charge interaction of Cr-O and Si-O is stronger than that of the AI-0 atoms. In particular, the Cr element effectively improves the shear deformation resistance and elastic stiffness of PtAl. With increasing Cr concentration, the formation of Cr-Al bond enhances the elastic stiffness and shear deformation resistance of PtAl. Therefore, our results predict that Cr is a useful element to improve the overall performance of PtAl thermal barrier coating.
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Source :
VACUUM
ISSN: 0042-207X
Year: 2020
Volume: 172
4 . 0 0 0
JCR@2022
ESI Discipline: MATERIALS SCIENCE;
ESI HC Threshold:169
Cited Count:
WoS CC Cited Count: 70
SCOPUS Cited Count: 69
ESI Highly Cited Papers on the List: 8 Unfold All
WanFang Cited Count:
Chinese Cited Count:
30 Days PV: 5
Affiliated Colleges: