ASE database

ID Formula str_E Maximum force Calculator Age distance Maximum stress
26 Au54O -169.953 0.008 vasp 15M 1.207 0.011
27 Au54F -168.878 0.007 vasp 15M 1.450 0.011
28 Au54Ne -165.084 0.009 vasp 15M 3.533 0.011
29 Au54Na -167.438 0.007 vasp 15M 2.311 0.011
30 Au54Mg -166.817 0.010 vasp 15M 1.912 0.012
31 AlAu54 -168.662 0.010 vasp 15M 1.789 0.012
32 Au54Si -169.936 0.004 vasp 15M 1.628 0.012
33 Au54P -170.059 0.009 vasp 15M 1.558 0.011
34 Au54S -169.436 0.005 vasp 15M 1.610 0.011
35 Au54Cl -168.055 0.005 vasp 15M 1.850 0.011
36 Au54Ar -165.093 0.008 vasp 15M 3.651 0.011
37 Au54H -168.134 0.009 vasp 15M 1.595 0.011
38 Au54He -165.067 0.008 vasp 15M 3.705 0.011
39 Au54Li -167.627 0.005 vasp 15M 2.190 0.011
40 Au54Be -166.735 0.007 vasp 15M 2.075 0.011
41 Au54B -168.412 0.007 vasp 15M 1.936 0.011
42 Au54C -169.007 0.010 vasp 15M 1.843 0.011
43 Au54N -168.955 0.005 vasp 15M 1.846 0.011
44 Au54O -168.874 0.009 vasp 15M 1.899 0.010
45 Au54F -168.510 0.008 vasp 15M 2.054 0.010
46 Au54Ne -165.081 0.007 vasp 15M 3.612 0.011
47 Au54Na -167.240 0.008 vasp 15M 2.484 0.011
48 Au54Mg -166.341 0.010 vasp 15M 2.361 0.011
49 AlAu54 -168.104 0.008 vasp 15M 2.346 0.011
50 Au54Si -168.778 0.007 vasp 15M 2.049 0.011