Investigation of Ti Addition Effects on the Thickness of 55 pct Al-Zn-1.6 pct Si Coating by First-Principles Calculation

First-principles method was performed to predict the effect of Ti addition on thickness and adhesion of 55 pct Al-Zn-1.6 pct Si coating. The results of optimized geometric configurations, total energy, and charge distributions for the Ti substitution in Fe2Al5 and FeAl3 phases indicated Ti will grab...

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Veröffentlicht in:Metallurgical and materials transactions. A, Physical metallurgy and materials science Physical metallurgy and materials science, 2012-06, Vol.43 (6), p.2012-2017
Hauptverfasser: Wu, Guangxin, Zhang, Jieyu, Ren, Yuling, Li, Guoyang, Wu, Xiaochun, Li, Qian, Chou, Kuochih
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Sprache:eng
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