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. 2018 Sep 5;9:3597. doi: 10.1038/s41467-018-06074-8

Table 1.

Parameters calculated from literature X-ray crystallography structures for armchair and zig-zag twin boundaries in graphite, hBN and MoSe2

Graphite hBN MoSe2
Direction of twin boundary ac  zz ac zz ac zz
Slip direction zz  ac zz ac zz ac
L slip α α / √ 3 2α / √ 3 3α / √ 3 α 3α / √ 3 α 3α / √ 3
c (nm) 0.67 0.67 0.67 0.67 0.67 0.67 1.23 1.23
a (nm) 0.25 0.25 0.25 0.25 0.25 0.25 0.33 0.33
Lslip (nm) 0.25 0.14 0.29 0.43 0.25 0.43 0.33 0.56
θt(°) 40.3 23.9 46.0 64.9 41.2 65.9 30.0 48.6

Higher order twin zz angles in graphite (2α/√3 and 3α/√3) are likely to be less favourable due to the ease of splitting of such basal dislocations into separate partial dislocations with lower energy