ASE database

ID Formula ads_site Charge PBC Username Maximum stress ads_E Age Mass
26 Au54O 1b 0.000 TTT hecc 0.011 -3.356 15M 10652.194
27 Au54F 1b 0.000 TTT hecc 0.011 -3.390 15M 10655.193
28 Au54Ne 1b 0.000 TTT hecc 0.011 -0.008 15M 10656.374
29 Au54Na 1b 0.000 TTT hecc 0.011 -2.150 15M 10659.184
30 Au54Mg 1b 0.000 TTT hecc 0.012 -1.750 15M 10660.500
31 AlAu54 1b 0.000 TTT hecc 0.012 -3.303 15M 10663.176
32 Au54Si 1b 0.000 TTT hecc 0.012 -4.042 15M 10664.280
33 Au54P 1b 0.000 TTT hecc 0.011 -3.107 15M 10667.168
34 Au54S 1b 0.000 TTT hecc 0.011 -3.427 15M 10668.255
35 Au54Cl 1b 0.000 TTT hecc 0.011 -2.748 15M 10671.645
36 Au54Ar 1b 0.000 TTT hecc 0.011 -0.004 15M 10676.143
37 Au54H 0t 0.000 TTT hecc 0.011 -1.953 15M 10637.203
38 Au54He 0t 0.000 TTT hecc 0.011 -0.005 15M 10640.197
39 Au54Li 0t 0.000 TTT hecc 0.011 -2.265 15M 10643.135
40 Au54Be 0t 0.000 TTT hecc 0.011 -1.631 15M 10645.207
41 Au54B 0t 0.000 TTT hecc 0.011 -2.999 15M 10647.005
42 Au54C 0t 0.000 TTT hecc 0.011 -2.695 15M 10648.206
43 Au54N 0t 0.000 TTT hecc 0.011 -0.767 15M 10650.202
44 Au54O 0t 0.000 TTT hecc 0.010 -2.278 15M 10652.194
45 Au54F 0t 0.000 TTT hecc 0.010 -3.022 15M 10655.193
46 Au54Ne 0t 0.000 TTT hecc 0.011 -0.004 15M 10656.374
47 Au54Na 0t 0.000 TTT hecc 0.011 -1.952 15M 10659.184
48 Au54Mg 0t 0.000 TTT hecc 0.011 -1.273 15M 10660.500
49 AlAu54 0t 0.000 TTT hecc 0.011 -2.745 15M 10663.176
50 Au54Si 0t 0.000 TTT hecc 0.011 -2.884 15M 10664.280