↓ ID ✕ | Formula ✕ | ads_E ✕ | Calculator ✕ | Charge ✕ | PBC ✕ |
---|---|---|---|---|---|
51 | Au54P | -1.663 | vasp | 0.000 | TTT |
52 | Au54S | -2.279 | vasp | 0.000 | TTT |
53 | Au54Cl | -2.402 | vasp | 0.000 | TTT |
54 | Au54Ar | -0.003 | vasp | 0.000 | TTT |
55 | Au72H | -1.683 | vasp | 0.000 | TTT |
56 | Au72He | -0.005 | vasp | 0.000 | TTT |
57 | Au72Li | -2.954 | vasp | 0.000 | TTT |
58 | Au72Be | -3.785 | vasp | 0.000 | TTT |
59 | Au72B | -5.089 | vasp | 0.000 | TTT |
60 | Au72C | -4.383 | vasp | 0.000 | TTT |
61 | Au72N | -2.009 | vasp | 0.000 | TTT |
62 | Au72O | -2.954 | vasp | 0.000 | TTT |
63 | Au72F | -3.008 | vasp | 0.000 | TTT |
64 | Au72Ne | -0.008 | vasp | 0.000 | TTT |
65 | Au72Na | -2.503 | vasp | 0.000 | TTT |
66 | Au72Mg | -2.706 | vasp | 0.000 | TTT |
67 | AlAu72 | -4.343 | vasp | 0.000 | TTT |
68 | Au72Si | -4.977 | vasp | 0.000 | TTT |
69 | Au72P | -3.831 | vasp | 0.000 | TTT |
70 | Au72S | -3.509 | vasp | 0.000 | TTT |
71 | Au72Cl | -2.405 | vasp | 0.000 | TTT |
72 | Au72Ar | -0.002 | vasp | 0.000 | TTT |
73 | Au72H | -1.957 | vasp | 0.000 | TTT |
74 | Au72He | -0.005 | vasp | 0.000 | TTT |
75 | Au72Li | -2.846 | vasp | 0.000 | TTT |