ASE database

ID Formula plane_index ads_E slab_E Volume
1 Au54H 100 -1.889 -165.064 2654.442
2 Au54He 100 -0.007 -165.064 2654.442
3 Au54Li 100 -2.868 -165.064 2654.442
4 Au54Be 100 -4.044 -165.064 2654.442
5 Au54B 100 -5.643 -165.064 2654.442
6 Au54C 100 -4.895 -165.064 2654.442
7 Au54N 100 -2.390 -165.064 2654.442
8 Au54O 100 -3.329 -165.064 2654.442
9 Au54F 100 -3.208 -165.064 2654.442
10 Au54Ne 100 -0.009 -165.064 2654.442
11 Au54Na 100 -2.363 -165.064 2654.442
12 Au54Mg 100 -2.441 -165.064 2654.442
13 AlAu54 100 -4.253 -165.064 2654.442
14 Au54Si 100 -5.051 -165.064 2654.442
15 Au54P 100 -4.079 -165.064 2654.442
16 Au54S 100 -3.898 -165.064 2654.442
17 Au54Cl 100 -2.562 -165.064 2654.442
18 Au54Ar 100 -0.005 -165.064 2654.442
19 Au54H 100 -2.247 -165.064 2654.442
20 Au54He 100 -0.007 -165.064 2654.442
21 Au54Li 100 -2.541 -165.064 2654.442
22 Au54Be 100 -2.713 -165.064 2654.442
23 Au54B 100 -4.341 -165.064 2654.442
24 Au54C 100 -4.185 -165.064 2654.442
25 Au54N 100 -2.172 -165.064 2654.442