Open Catalyst Project (FAIR/CMU) |
DimeNet++-1.8M-Forceonly-20M-Rattled |
44.8 |
0.2 |
15.6 |
39.4 |
0 |
12.6 |
44.3 |
0 |
11.7 |
47.3 |
0 |
10.2 |
2021/02/22 |
Open Catalyst Project (FAIR/CMU) |
SchNet-9M-Forceonly-20M-Rattled |
38 |
0.4 |
8.02 |
33.4 |
0 |
4.59 |
36.2 |
0 |
4.46 |
39.4 |
0 |
3.75 |
2021/02/21 |
Open Catalyst Project (FAIR/CMU) |
DimeNet++-1.8M-Forceonly-20M-MD |
48.6 |
0.2 |
21.1 |
43 |
0 |
17.1 |
48.2 |
0 |
16.4 |
51.1 |
0.394 |
14 |
2021/02/21 |
Open Catalyst Project (FAIR/CMU) |
SchNet-9M-Forceonly-20M-MD |
42.9 |
0.6 |
13.2 |
37.6 |
0 |
8.24 |
40.4 |
0 |
8.06 |
43.5 |
0 |
6.39 |
2021/02/21 |
Open Catalyst Project (FAIR/CMU) |
DimeNet++-10.7M-Forceonly-All |
52.5 |
1 |
25.6 |
48.5 |
0.403 |
20.7 |
51 |
0 |
20.2 |
54.8 |
0.197 |
20.7 |
2021/02/21 |
Open Catalyst Project (FAIR/CMU) |
DimeNet++-1.8M-Forceonly-All |
48.8 |
0.6 |
17.5 |
45.2 |
0.202 |
14.7 |
48.6 |
0 |
14.3 |
53.1 |
0.197 |
14.4 |
2021/02/21 |