Shaohua Lu, Xiongtao Zhang, Yuhao Zheng, 等. Preferential orientation of diamond formation on TaC: Diamond(111)//TaC(111)[J]. Functional Diamond, 2024,4(1).
Shaohua Lu, Xiongtao Zhang, Yuhao Zheng, et al. Preferential orientation of diamond formation on TaC: Diamond(111)//TaC(111)[J]. Functional Diamond2024, 4(1).
Shaohua Lu, Xiongtao Zhang, Yuhao Zheng, 等. Preferential orientation of diamond formation on TaC: Diamond(111)//TaC(111)[J]. Functional Diamond, 2024,4(1). DOI: 10.1080/26941112.2023.2300764.
Shaohua Lu, Xiongtao Zhang, Yuhao Zheng, et al. Preferential orientation of diamond formation on TaC: Diamond(111)//TaC(111)[J]. Functional Diamond2024, 4(1). DOI: 10.1080/26941112.2023.2300764.
Preferential orientation of diamond formation on TaC: Diamond(111)//TaC(111)
摘要
Abstract
Experimental results showed that for the diamond film prepared by hot filament chemical vapor deposition (HFCVD) using Ta filament
TaC existed between diamond and the silicon substrate
and diamond grew directly on TaC
while the inherent mechanism was not clear. Here
a special coherent interface Diamond(111)//TaC(111) is observed using high resolution transmission electron microscopy
and then we explore the effects of the TaC with different lattice planes on the diamond formation by first-principle calculations. The results show that C tends to adsorb on the TaC(111) C-terminated surface. The strong covalent bond between C from diamond and Ta from TaC is formed in the Diamond(111)//TaC(111) interface
while only C–C covalent bonds are formed at the Graphite(002)/TaC(111). This makes diamond thermodynamically more stable than graphite on the TaC surfaces. Our investigations provide critical information to understand the complex diamond formation mechanism
especially with the presence of TaC.
关键词
Keywords
references
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