Cluster description: examples
Here are some specific examples of cluster specifications. You can use them as templates.
O/W(110)-(1x1) with emission from the top-most W layer
layer O 1.51 0 0.95 2.7366 2.7366 -35.26439 70.52878 surface W 0 0 0 3.16 bcc110 emitter 0 0 0 end
O/Cu(110)-(2x1) with emission from the O layer
layer O 0 0 0 5.1053 3.61 0 90 layer Cu 0 1.805 0.09 5.1053 3.61 0 90 surface Cu 1.2763 0 -1.52 3.61 fcc110 emitter 0 0 0 end
S/Ni(110)-(2x1) with emission from the S layer
layer S 1.76 0 0 4.978 4.978 0 90 surface Ni 1.76 1.245 0 3.52 fcc110 emitter 1.76 0 0 end
Diamond (100) with emission from the top-most layer
surface C 0 0 0 3.57 fcc100 surface C 0.8925 0.8925 -0.8925 3.57 fcc100 emitter 0 0 0 end
One single Xe atom adsorbed on Pt(111) (bridge site). Emission from Xe.
atom Xe 0 0 0 surface Pt 0 1.386 -2.263 3.92 fcc110 emitter 0 0 0 end
