↓ ID ✕ | Formula ✕ | ads_E ✕ | Calculator ✕ | Charge ✕ | PBC ✕ |
---|---|---|---|---|---|
76 | Au72Be | -3.681 | vasp | 0.000 | TTT |
77 | Au72B | -5.161 | vasp | 0.000 | TTT |
78 | Au72C | -4.581 | vasp | 0.000 | TTT |
79 | Au72N | -1.930 | vasp | 0.000 | TTT |
80 | Au72O | -3.169 | vasp | 0.000 | TTT |
81 | Au72F | -3.294 | vasp | 0.000 | TTT |
82 | Au72Ne | -0.009 | vasp | 0.000 | TTT |
83 | Au72Na | -2.393 | vasp | 0.000 | TTT |
84 | Au72Mg | -2.455 | vasp | 0.000 | TTT |
85 | AlAu72 | -4.039 | vasp | 0.000 | TTT |
86 | Au72Si | -4.598 | vasp | 0.000 | TTT |
87 | Au72P | -3.429 | vasp | 0.000 | TTT |
88 | Au72S | -3.435 | vasp | 0.000 | TTT |
89 | Au72Cl | -2.727 | vasp | 0.000 | TTT |
90 | Au72Ar | 0.000 | vasp | 0.000 | TTT |
91 | Au72H | -2.313 | vasp | 0.000 | TTT |
92 | Au72He | -0.005 | vasp | 0.000 | TTT |
93 | Au72Li | -2.432 | vasp | 0.000 | TTT |
94 | Au72Be | -3.432 | vasp | 0.000 | TTT |
95 | Au72B | -5.288 | vasp | 0.000 | TTT |
96 | Au72C | -4.339 | vasp | 0.000 | TTT |
97 | Au72N | -2.263 | vasp | 0.000 | TTT |
98 | Au72O | -3.463 | vasp | 0.000 | TTT |
99 | Au72F | -3.451 | vasp | 0.000 | TTT |
100 | Au72Ne | -0.007 | vasp | 0.000 | TTT |