X-Git-Url: https://hackdaworld.org/gitweb/?p=lectures%2Flatex.git;a=blobdiff_plain;f=posic%2Fthesis%2Fdefects.tex;fp=posic%2Fthesis%2Fdefects.tex;h=18c7d3aa61c675a70295ae5980ed90fcbef6a2f8;hp=d1c856c4fbe096e91ce01cb4c8e3b72fd194ed40;hb=5b013258b564a15f580b0b4275067c44da4e15ce;hpb=15b22d0a93a669cf8c7ad59185e553e634c57c1d diff --git a/posic/thesis/defects.tex b/posic/thesis/defects.tex index d1c856c..18c7d3a 100644 --- a/posic/thesis/defects.tex +++ b/posic/thesis/defects.tex @@ -283,7 +283,7 @@ However, in calculations performed in this work, which fully account for the spi This is discussed in more detail in section~\ref{subsection:100mig}. To conclude, discrepancies between the results from classical potential calculations and those obtained from first principles are observed. -Within the classical potentials EA outperforms Tersoff and is, therefore, used for further studies. +Within the classical potentials, EA outperforms Tersoff and is, therefore, used for further studies. Both methods (EA and DFT) predict the \ci{} \hkl<1 0 0> DB configuration to be most stable. Also the remaining defects and their energetic order are described fairly well. It is thus concluded that, so far, modeling of the SiC precipitation by the EA potential might lead to trustable results.