ASE database

Displaying rows 1-25 out of 31
↓ ID ✕ Formula ✕ PBC ✕ Energy ✕ Number of atoms ✕
1 C60H18 TTT -601.226 78
2 C60H18 TTT -597.550 78
3 C60H18 TTT -594.198 78
4 C60H18 TTT -595.860 78
5 C60H18 TTT -594.706 78
6 C60H18 TTT -595.719 78
7 C60H18 TTT -596.924 78
8 C60H18 TTT -597.862 78
9 C60H18 TTT -595.755 78
10 C60H18 TTT -595.314 78
11 C60H18 TTT -594.009 78
12 C60H18 TTT -589.931 78
13 C60H18 TTT -593.931 78
14 C60H18 TTT -592.196 78
15 C60H18 TTT -595.084 78
16 C60H18 TTT -597.082 78
17 C60H18 TTT -596.384 78
18 C60H18 TTT -596.571 78
19 C60H18 TTT -596.873 78
20 C60H18 TTT -592.840 78
21 C60H18 TTT -596.337 78
22 C60H18 TTT -594.138 78
23 C60H18 TTT -598.073 78
24 C60H18 TTT -595.946 78
25 C60H18 TTT -593.749 78