ASE database

ID Formula Magnetic moment Username Maximum force plane_index Age Maximum stress ads_site Calculator
51 Au54P -0.002 hecc 0.004 100 15M 0.011 0t vasp
52 Au54S -0.000 hecc 0.009 100 15M 0.011 0t vasp
53 Au54Cl -0.000 hecc 0.008 100 15M 0.010 0t vasp
54 Au54Ar 0.000 hecc 0.005 100 15M 0.011 0t vasp
55 Au72H 0.000 hecc 0.010 110 15M 0.013 2f vasp
56 Au72He 0.000 hecc 0.008 110 15M 0.013 2f vasp
57 Au72Li -0.000 hecc 0.010 110 15M 0.014 2f vasp
58 Au72Be 0.000 hecc 0.007 110 15M 0.014 2f vasp
59 Au72B 0.000 hecc 0.009 110 15M 0.014 2f vasp
60 Au72C -0.000 hecc 0.009 110 15M 0.013 2f vasp
61 Au72N 0.000 hecc 0.007 110 15M 0.013 2f vasp
62 Au72O -0.000 hecc 0.008 110 15M 0.013 2f vasp
63 Au72F -0.000 hecc 0.010 110 15M 0.013 2f vasp
64 Au72Ne 0.000 hecc 0.008 110 15M 0.013 2f vasp
65 Au72Na 0.000 hecc 0.006 110 15M 0.014 2f vasp
66 Au72Mg -0.000 hecc 0.005 110 15M 0.014 2f vasp
67 AlAu72 -0.000 hecc 0.005 110 15M 0.013 2f vasp
68 Au72Si 0.000 hecc 0.007 110 15M 0.013 2f vasp
69 Au72P -0.000 hecc 0.009 110 15M 0.013 2f vasp
70 Au72S 0.000 hecc 0.005 110 15M 0.013 2f vasp
71 Au72Cl 0.000 hecc 0.010 110 15M 0.013 2f vasp
72 Au72Ar 0.000 hecc 0.007 110 15M 0.013 2f vasp
73 Au72H 0.000 hecc 0.009 110 15M 0.013 3b vasp
74 Au72He -0.000 hecc 0.010 110 15M 0.013 3b vasp
75 Au72Li 0.000 hecc 0.010 110 15M 0.014 3b vasp