ASE database

distance Age ads_site atom_E str_E PBC Mass ads_E Dipole_val
2.376 13M 3h -0.225 -195.024 TTT 17285.869 -1.954 -4.502
2.025 13M 3h -0.004 -194.556 TTT 17285.869 -1.707 -2.595
1.820 13M 3h -0.295 -196.324 TTT 17285.869 -3.184 -1.006
1.670 13M 3h -0.830 -197.777 TTT 17285.869 -4.102 0.043
1.593 13M 3h -1.888 -198.547 TTT 17285.869 -3.815 0.624
1.602 13M 3h -0.945 -198.308 TTT 17285.869 -4.518 0.764
1.841 13M 3h -0.243 -196.481 TTT 17285.869 -3.393 0.388
3.920 13M 3h -0.025 -192.878 TTT 17285.869 -0.008 -0.053
0.916 13M 1b -1.120 -196.523 TTT 17285.869 -2.559 0.014
3.776 13M 1b 0.002 -192.846 TTT 17285.869 -0.003 -0.017
2.025 13M 1b -0.299 -195.466 TTT 17285.869 -2.322 -3.370
1.308 13M 1b -0.039 -195.474 TTT 17285.869 -2.589 -0.736
0.834 13M 1b -0.349 -197.691 TTT 17285.869 -4.498 0.322
0.665 13M 1b -1.250 -199.256 TTT 17285.869 -5.161 0.460
0.958 13M 1b -3.120 -199.896 TTT 17285.869 -3.931 0.716
1.073 13M 1b -1.530 -199.469 TTT 17285.869 -5.094 0.781
1.409 13M 1b -0.424 -197.505 TTT 17285.869 -4.236 0.687
3.657 13M 1b -0.013 -192.866 TTT 17285.869 -0.008 -0.008
2.384 13M 1b -0.225 -195.018 TTT 17285.869 -1.948 -4.513
1.991 13M 1b -0.004 -194.540 TTT 17285.869 -1.691 -2.577
1.820 13M 1b -0.295 -196.341 TTT 17285.869 -3.201 -0.999
1.654 13M 1b -0.830 -197.812 TTT 17285.869 -4.137 0.034
1.585 13M 1b -1.890 -198.588 TTT 17285.869 -3.853 0.602
1.587 13M 1b -0.945 -198.347 TTT 17285.869 -4.557 0.738
1.895 13M 1b -0.243 -196.406 TTT 17285.869 -3.318 0.581