ASE database

ID Formula Charge slab_E Energy ads_site plane_index
26 Au54O 0.000 -165.064 -169.953 1b 100
27 Au54F 0.000 -165.064 -168.878 1b 100
28 Au54Ne 0.000 -165.064 -165.084 1b 100
29 Au54Na 0.000 -165.064 -167.438 1b 100
30 Au54Mg 0.000 -165.064 -166.817 1b 100
31 AlAu54 0.000 -165.064 -168.662 1b 100
32 Au54Si 0.000 -165.064 -169.936 1b 100
33 Au54P 0.000 -165.064 -170.059 1b 100
34 Au54S 0.000 -165.064 -169.436 1b 100
35 Au54Cl 0.000 -165.064 -168.055 1b 100
36 Au54Ar 0.000 -165.064 -165.093 1b 100
37 Au54H 0.000 -165.064 -168.134 0t 100
38 Au54He 0.000 -165.064 -165.067 0t 100
39 Au54Li 0.000 -165.064 -167.627 0t 100
40 Au54Be 0.000 -165.064 -166.735 0t 100
41 Au54B 0.000 -165.064 -168.412 0t 100
42 Au54C 0.000 -165.064 -169.007 0t 100
43 Au54N 0.000 -165.064 -168.955 0t 100
44 Au54O 0.000 -165.064 -168.874 0t 100
45 Au54F 0.000 -165.064 -168.510 0t 100
46 Au54Ne 0.000 -165.064 -165.081 0t 100
47 Au54Na 0.000 -165.064 -167.240 0t 100
48 Au54Mg 0.000 -165.064 -166.341 0t 100
49 AlAu54 0.000 -165.064 -168.104 0t 100
50 Au54Si 0.000 -165.064 -168.778 0t 100