ASE database

ID Formula Age Maximum force str_E ads_site Mass Dipole_val
51 Au54P 15M 0.004 -168.614 0t 10667.168 0.133
52 Au54S 15M 0.009 -168.287 0t 10668.255 1.591
53 Au54Cl 15M 0.008 -167.708 0t 10671.645 2.287
54 Au54Ar 15M 0.005 -165.092 0t 10676.143 -0.102
55 Au72H 15M 0.010 -221.327 2f 14182.601 -0.181
56 Au72He 15M 0.008 -218.530 2f 14185.596 -0.016
57 Au72Li 15M 0.010 -221.779 2f 14188.533 -1.996
58 Au72Be 15M 0.007 -222.351 2f 14190.605 -0.158
59 Au72B 15M 0.009 -223.965 2f 14192.403 0.170
60 Au72C 15M 0.009 -224.158 2f 14193.604 0.284
61 Au72N 15M 0.007 -223.660 2f 14195.600 0.438
62 Au72O 15M 0.008 -223.013 2f 14197.592 0.578
63 Au72F 15M 0.010 -221.958 2f 14200.591 1.101
64 Au72Ne 15M 0.008 -218.548 2f 14201.773 -0.007
65 Au72Na 15M 0.006 -221.255 2f 14204.583 -3.683
66 Au72Mg 15M 0.005 -221.237 2f 14205.898 -1.984
67 AlAu72 15M 0.005 -223.165 2f 14208.575 -0.572
68 Au72Si 15M 0.007 -224.334 2f 14209.678 -0.022
69 Au72P 15M 0.009 -224.246 2f 14212.567 0.189
70 Au72S 15M 0.005 -222.981 2f 14213.653 0.303
71 Au72Cl 15M 0.010 -221.174 2f 14217.043 1.191
72 Au72Ar 15M 0.007 -218.555 2f 14221.541 -0.072
73 Au72H 15M 0.009 -221.601 3b 14182.601 -0.028
74 Au72He 15M 0.010 -218.530 3b 14185.596 -0.021
75 Au72Li 15M 0.010 -221.672 3b 14188.533 -2.222