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. 2019 Oct 14;9(56):32712–32720. doi: 10.1039/c9ra07111c

The calculated lattice constant of graphene and metal supercell (ag, bg and am, bm), lattice strain of graphene (a% and b%), calculated average equilibrium interfacial distance (deq), binding energy (Eb) and the maximum buckling on the graphene layer are listed.

g–Ni(111) g–Co(111) g–Cu(111) g–Ni(110) g–Co(110) g–Cu(110) g–Ni(100) g–Co(100) g–Cu(100)
a g (Å) 9.784 9.784 9.784 4.892 4.892 4.892 4.892 4.892 4.892
b g (Å) 9.784 9.784 9.784 16.947 16.947 16.947 16.947 16.947 12.710
a m (Å) 9.666 9.527 9.968 4.833 4.763 4.984 4.833 4.763 4.984
b m (Å) 9.666 9.527 9.968 17.086 16.841 17.621 16.915 16.672 12.460
a% 1.221 2.698 −1.846 1.221 2.698 −1.846 1.221 2.698 −1.846
b% 1.221 2.698 −1.846 −0.814 0.629 −3.825 0.189 1.649 2.006
d eq (Å) 2.016 1.976 3.004 2.004 2.028 2.257 2.165 2.209 2.734
d Ref (Å) 2.05a 2.05a 3.26a 2.03b 2.13b
E b (eV per C) 0.135 0.259 0.022 0.178 0.221 0.017 0.175 0.162 0.028
E Ref (eV per C) 0.125a 0.160a 0.033a 0.209b 0.180b
Buckling (Å) 0.0010 0.0102 0.0006 0.2016 0.3694 0.1192 1.0178 1.2743 0.8924
BucklingRef (Å) 0.00a 0.29b 0.69b