ASE database

Displaying rows 26-8 out of 8
↓ ID ✕ Calculator ✕ PBC ✕ str_E ✕ Magnetic moment ✕ atom_E ✕
26 vasp TTT -169.953 -0.000 -1.533
27 vasp TTT -168.878 0.000 -0.424
28 vasp TTT -165.084 0.000 -0.013
29 vasp TTT -167.438 0.000 -0.225
30 vasp TTT -166.817 0.000 -0.004
31 vasp TTT -168.662 -0.000 -0.295
32 vasp TTT -169.936 -0.000 -0.830
33 vasp TTT -170.059 -0.000 -1.888
34 vasp TTT -169.436 0.000 -0.945
35 vasp TTT -168.055 0.000 -0.243
36 vasp TTT -165.093 0.000 -0.025
37 vasp TTT -168.134 -0.000 -1.117
38 vasp TTT -165.067 0.000 0.002
39 vasp TTT -167.627 -0.000 -0.299
40 vasp TTT -166.735 0.000 -0.039
41 vasp TTT -168.412 0.000 -0.349
42 vasp TTT -169.007 0.000 -1.248
43 vasp TTT -168.955 0.000 -3.124
44 vasp TTT -168.874 0.000 -1.533
45 vasp TTT -168.510 -0.000 -0.424
46 vasp TTT -165.081 0.000 -0.013
47 vasp TTT -167.240 0.000 -0.225
48 vasp TTT -166.341 -0.000 -0.004
49 vasp TTT -168.104 0.000 -0.295
50 vasp TTT -168.778 -0.000 -0.830