Abstract The lattice misfit of the different CeO2/TiC planes was calculated by Bramfitt two-dimensional lattice misfit degree theory. Then, the interface relation of CeO2(100)/TiC(111) was calculated by first principles, and the possibility of CeO2 as the heterogeneous nucleus of TiC was analyzed as well. Hypereutectic Fe-Cr-C-Ti-CeO2 hardfacing alloy was prepared in this paper, and its microstructure was observed by Scanning Electron Microscope (SEM) and Transmission Electron Microscope (TEM). The calculated results show that the lattice misfit between CeO2 (100) and TiC (111) is 6.09%, which indicates that it is moderately effective for the CeO2 as the TiC heterogeneous nucleus. Four interfaces exist between CeO2 and TiC, which are Ce-C, Ce-Ti, O-C, and O-Ti ones. The interface adhesive works of Ce-C and Ce-Ti interfaces are small, and their interface energies are large, which indicates that they are extremely unstable and easy to decompose. However, the interface adhesive works of O-C and O-Ti interfaces are large, and their interface energies are small, which indicates that the two interfaces are thermodynamic stable. In addition, The O-C interface consists of covalent and metallic bonds, meanwhile the O-Ti interface consists of covalent, ionic and metallic bonds. Therefore, CeO2 can be as the heterogeneous nucleus of TiC. The experimental results show that CeO2 exists in TiC, which proves that CeO2 can be as the heterogeneous nucleus of TiC, then refines TiC.
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