Abstract:
The effect of discontinuous interfacial phase Al
4C
3 on the interface bonding of SiC/Al composites was discussed by using the first-principle approach based on density functional theory and experimental method, in comparison, the interface without new phase was also investigated. The results show that the C atom adsorbed on the surface of Al(111) is the most stable at the bridge position, and the adsorption energy of C atoms decreases gradually with the increase of C coverage. The formation of a discontinuous Al
4C
3 product leads to the interface changing from SiC/Al to (SiC+Al
4C
3)/Al, and their corresponding work of interfacial adhesion increases from 0.851 J/m
2 to 1.231 J/m
2, which is attributed to the fact that covalent bonds or ionic bonds are formed between C atoms with Al atoms when C atoms are adsorbed on the surface of Al, and covalent bonds between C atoms with Si atoms. In addition, the calculated adhesions of SiC/Al, (SiC+Al
4C
3)/Al system by first-principles are in good agreement with these of experiment, which has high reference value.