Computational study of anisotropic epitaxial recrystallization in 4H-SiC
Computational study of anisotropic epitaxial recrystallization in 4H-SiC
Gao, F.; Zhang, Y.; Posselt, M.; Weber, W. J.
Abstract
Two nano-sized amorphous layers were created within a crystalline cell to study anisotropic expitaxial recrystallization using molecular dynamics (MD) methods in 4H-SiC. Both amorphous layers were created with the normal of the amorphous-crystalline (a-c) interfaces along the [0001] direction, but one had a microscopic extension along the [(1) over bar2 (1) over bar0] direction, i.e. the dimension along the [(1) over bar2 (1) over bar0] direction is much larger than that along the [(1) over bar 010] direction (I-x model), and the other had a microscopic extension along the [(1) over bar 010] direction (I-y model). The amorphous layer within the I-x model can be completely recrystallized at 2000 K within an achievable simulation time, and the recrystallization is driven by a step-regrowth mechanism. On the other hand, the nucleation and growth of secondary ordered phases are observed at high temperatures in the I-y model. The temperature for recrystallization of the amorphous!
layer into high-quality 4H-SiC is estimated to be below 1500 K. Compared with other models, it is found that the regrowth rates and recrystallization mechanisms depend strongly on the orientation of 4H-SiC, whereas the activation energy spectra for recrystallization processes are independent of any specific polytypic structure, with activation energies ranging from 0.8 to 1.7 eV.
Keywords: computer simulation; SiC; recrystallization; defects
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Journal of Physics: Condensed Matter 20(2008), 125203
DOI: 10.1088/0953-8984/20/12/125203
ISSN: 0953-8984/08/125203
Cited 3 times in Scopus
Permalink: https://www.hzdr.de/publications/Publ-11065