ASE database

ID Formula Username Number of atoms ads_E Energy atom_E
1 Au54H hecc 55 -1.889 -168.070 -1.117
2 Au54He hecc 55 -0.007 -165.069 0.002
3 Au54Li hecc 55 -2.868 -168.230 -0.299
4 Au54Be hecc 55 -4.044 -169.147 -0.039
5 Au54B hecc 55 -5.643 -171.055 -0.349
6 Au54C hecc 55 -4.895 -171.207 -1.248
7 Au54N hecc 55 -2.390 -170.577 -3.124
8 Au54O hecc 55 -3.329 -169.926 -1.533
9 Au54F hecc 55 -3.208 -168.695 -0.424
10 Au54Ne hecc 55 -0.009 -165.085 -0.013
11 Au54Na hecc 55 -2.363 -167.652 -0.225
12 Au54Mg hecc 55 -2.441 -167.509 -0.004
13 AlAu54 hecc 55 -4.253 -169.611 -0.295
14 Au54Si hecc 55 -5.051 -170.944 -0.830
15 Au54P hecc 55 -4.079 -171.031 -1.888
16 Au54S hecc 55 -3.898 -169.906 -0.945
17 Au54Cl hecc 55 -2.562 -167.868 -0.243
18 Au54Ar hecc 55 -0.005 -165.095 -0.025
19 Au54H hecc 55 -2.247 -168.428 -1.117
20 Au54He hecc 55 -0.007 -165.069 0.002
21 Au54Li hecc 55 -2.541 -167.904 -0.299
22 Au54Be hecc 55 -2.713 -167.816 -0.039
23 Au54B hecc 55 -4.341 -169.754 -0.349
24 Au54C hecc 55 -4.185 -170.497 -1.248
25 Au54N hecc 55 -2.172 -170.360 -3.124