ASE database

Displaying rows 551-8 out of 8
Mass ✕ Calculator ✕ distance ✕ Energy ✕ PBC ✕ ads_E ✕ Volume ✕ Charge ✕ atom_E ✕
17285.869 vasp 2.376 -195.024 TTT -1.954 1730.483 0.000 -0.225
17285.869 vasp 2.025 -194.556 TTT -1.707 1730.483 0.000 -0.004
17285.869 vasp 1.820 -196.324 TTT -3.184 1730.483 0.000 -0.295
17285.869 vasp 1.670 -197.777 TTT -4.102 1730.483 0.000 -0.830
17285.869 vasp 1.593 -198.547 TTT -3.815 1730.483 0.000 -1.888
17285.869 vasp 1.602 -198.308 TTT -4.518 1730.483 0.000 -0.945
17285.869 vasp 1.841 -196.481 TTT -3.393 1730.483 0.000 -0.243
17285.869 vasp 3.920 -192.878 TTT -0.008 1730.483 0.000 -0.025
17285.869 vasp 0.916 -196.523 TTT -2.559 1730.483 0.000 -1.120
17285.869 vasp 3.776 -192.846 TTT -0.003 1730.483 0.000 0.002
17285.869 vasp 2.025 -195.466 TTT -2.322 1730.483 0.000 -0.299
17285.869 vasp 1.308 -195.474 TTT -2.589 1730.483 0.000 -0.039
17285.869 vasp 0.834 -197.691 TTT -4.498 1730.483 0.000 -0.349
17285.869 vasp 0.665 -199.256 TTT -5.161 1730.483 0.000 -1.250
17285.869 vasp 0.958 -199.896 TTT -3.931 1730.483 0.000 -3.120
17285.869 vasp 1.073 -199.469 TTT -5.094 1730.483 0.000 -1.530
17285.869 vasp 1.409 -197.505 TTT -4.236 1730.483 0.000 -0.424
17285.869 vasp 3.657 -192.866 TTT -0.008 1730.483 0.000 -0.013
17285.869 vasp 2.384 -195.018 TTT -1.948 1730.483 0.000 -0.225
17285.869 vasp 1.991 -194.540 TTT -1.691 1730.483 0.000 -0.004
17285.869 vasp 1.820 -196.341 TTT -3.201 1730.483 0.000 -0.295
17285.869 vasp 1.654 -197.812 TTT -4.137 1730.483 0.000 -0.830
17285.869 vasp 1.585 -198.588 TTT -3.853 1730.483 0.000 -1.890
17285.869 vasp 1.587 -198.347 TTT -4.557 1730.483 0.000 -0.945
17285.869 vasp 1.895 -196.406 TTT -3.318 1730.483 0.000 -0.243