ASE database

ID Formula Charge Calculator Volume Username Mass
1 C60H18 0.000 vasp 8000.000 mse-gucc 738.804
2 C60H18 0.000 vasp 7502.572 mse-gucc 738.804
3 C60H18 0.000 vasp 4843.699 mse-gucc 738.804
4 C60H18 0.000 vasp 8000.000 mse-gucc 738.804
5 C60H18 0.000 vasp 4901.317 mse-gucc 738.804
6 C60H18 0.000 vasp 3491.818 mse-gucc 738.804
7 C60H18 0.000 vasp 7583.240 mse-gucc 738.804
8 C60H18 0.000 vasp 4326.471 mse-gucc 738.804
9 C60H18 0.000 vasp 8000.000 mse-gucc 738.804
10 C60H18 0.000 vasp 3306.728 mse-gucc 738.804
11 C60H18 0.000 vasp 3208.464 mse-gucc 738.804
12 C60H18 0.000 vasp 4843.897 mse-gucc 738.804
13 C60H18 0.000 vasp 4350.536 mse-gucc 738.804
14 C60H18 0.000 vasp 4919.381 mse-gucc 738.804
15 C60H18 0.000 vasp 5597.694 mse-gucc 738.804
16 C60H18 0.000 vasp 4564.732 mse-gucc 738.804
17 C60H18 0.000 vasp 7498.766 mse-gucc 738.804
18 C60H18 0.000 vasp 8000.000 mse-gucc 738.804
19 C60H18 0.000 vasp 8000.000 mse-gucc 738.804
20 C60H18 0.000 vasp 8000.000 mse-gucc 738.804
21 C60H18 0.000 vasp 5184.820 mse-gucc 738.804
22 C60H18 0.000 vasp 8000.000 mse-gucc 738.804
23 C60H18 0.000 vasp 8000.000 mse-gucc 738.804
24 C60H18 0.000 vasp 4740.028 mse-gucc 738.804
25 C60H18 0.000 vasp 8000.000 mse-gucc 738.804