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- W2079754328 abstract "The α-WC(0001) surface and β-SiC(111)/α-WC(0001) interface were studied by first-principles calculation based on density functional theory. It is demonstrated that the α-WC(0001) surface models with more than nine atom-layers exhibit bulk-like interior, wherein the surface relaxations localized within the top three layers are well converged. Twenty-four specific geometry models of SiC/WC interface structures with different terminations and stacking sites were chosen. The calculated work of adhesion and interface energy suggest that the most stable interface structure has the C-C bonding across the interface, yielding the largest work of adhesion and the lowest interface energy. Moreover, the top-site stacking sequence is preferable for the C/C-terminated interface. The effects of the interface on the electronic structures of the C/C-terminated interfaces are mainly localized within the first and second layers of the interface. Calculations of the work of adhesion and interface energy provide theoretical evidence that the mechanical failure may initiate at the interface or in SiC but not in WC." @default.
- W2079754328 created "2016-06-24" @default.
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- W2079754328 date "2014-06-14" @default.
- W2079754328 modified "2023-10-16" @default.
- W2079754328 title "First-principles calculation on β-SiC(111)/α-WC(0001) interface" @default.
- W2079754328 cites W1621249408 @default.
- W2079754328 cites W1965664430 @default.
- W2079754328 cites W1966373197 @default.
- W2079754328 cites W1966924182 @default.
- W2079754328 cites W1967505556 @default.
- W2079754328 cites W1971106553 @default.
- W2079754328 cites W1971680193 @default.
- W2079754328 cites W1972721577 @default.
- W2079754328 cites W1973329239 @default.
- W2079754328 cites W1974126996 @default.
- W2079754328 cites W1976080631 @default.
- W2079754328 cites W1977785466 @default.
- W2079754328 cites W1978365214 @default.
- W2079754328 cites W1981368803 @default.
- W2079754328 cites W1990376653 @default.
- W2079754328 cites W1991024578 @default.
- W2079754328 cites W1992518593 @default.
- W2079754328 cites W1992553924 @default.
- W2079754328 cites W1999823261 @default.
- W2079754328 cites W2000498122 @default.
- W2079754328 cites W2000690514 @default.
- W2079754328 cites W2001325416 @default.
- W2079754328 cites W2002475665 @default.
- W2079754328 cites W2004130503 @default.
- W2079754328 cites W2005723374 @default.
- W2079754328 cites W2006247599 @default.
- W2079754328 cites W2007881118 @default.
- W2079754328 cites W2017027261 @default.
- W2079754328 cites W2018923883 @default.
- W2079754328 cites W2020471780 @default.
- W2079754328 cites W2023988308 @default.
- W2079754328 cites W2026907619 @default.
- W2079754328 cites W2027520599 @default.
- W2079754328 cites W2028768438 @default.
- W2079754328 cites W2030976617 @default.
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- W2079754328 cites W2033923626 @default.
- W2079754328 cites W2039626632 @default.
- W2079754328 cites W2041022895 @default.
- W2079754328 cites W2041187326 @default.
- W2079754328 cites W2049079467 @default.
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- W2079754328 cites W2079764346 @default.
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- W2079754328 cites W2087699199 @default.
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- W2079754328 cites W2103563475 @default.
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- W2079754328 cites W2118726068 @default.
- W2079754328 cites W2135882313 @default.
- W2079754328 cites W2151800339 @default.
- W2079754328 cites W2159752439 @default.
- W2079754328 cites W2166244948 @default.
- W2079754328 cites W2230728100 @default.
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- W2079754328 cites W2327289603 @default.
- W2079754328 cites W3103250498 @default.
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- W2079754328 doi "https://doi.org/10.1063/1.4883758" @default.
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