ASE database

ID Formula Number of atoms Volume Energy Magnetic moment
1 Cu48N 49 1271.601 -193.568 -0.000
2 Cu48N 49 1271.601 -191.730 0.000
3 Cu48N 49 1271.601 -193.479 0.000
4 Cu48F 49 1271.601 -190.260 -0.000
5 Cu48F 49 1271.601 -191.257 0.000
6 Cu48F 49 1271.601 -191.759 0.000
7 Cu48O 49 1271.601 -192.145 0.000
8 Cu48O 49 1271.601 -191.780 -0.000
9 Cu48O 49 1271.601 -193.280 -0.000
10 Cu48B 49 1271.601 -191.803 -0.000
11 Cu48B 49 1271.601 -190.274 -0.000
12 Cu48B 49 1271.601 -191.672 0.000
13 Cu48C 49 1271.601 -193.425 0.000
14 Cu48C 49 1271.601 -191.291 0.000
15 Cu48C 49 1271.601 -193.011 0.000
16 Cu48N 49 1599.670 -185.090 -0.000
17 Cu48N 49 1599.670 -185.935 -0.000
18 Cu48N 49 1599.670 -183.344 0.007
19 Cu48N 49 1599.670 -185.087 0.000
20 Cu48F 49 1599.670 -182.123 -0.000
21 Cu48F 49 1599.670 -183.516 0.000
22 Cu48F 49 1599.670 -183.493 0.000
23 Cu48F 49 1599.670 -183.214 -0.000
24 Cu48O 49 1599.670 -184.198 -0.000
25 Cu48O 49 1599.670 -184.799 0.000