ASE database

atom_E distance Energy Dipole_val ads_E Volume plane_index PBC Mass Username Magnetic moment Age
-0.039 1.451 -195.504 -0.793 -2.619 1730.483 111 TTT 17285.869 hecc 0.000 13M
-0.349 1.151 -197.683 0.375 -4.490 1730.483 111 TTT 17285.869 hecc -0.000 13M
-1.250 0.969 -199.306 0.645 -5.211 1730.483 111 TTT 17285.869 hecc -0.000 13M
-3.120 0.961 -199.897 0.716 -3.932 1730.483 111 TTT 17285.869 hecc -0.000 13M
-1.530 1.074 -199.470 0.779 -5.095 1730.483 111 TTT 17285.869 hecc -0.000 13M
-0.424 1.412 -197.506 0.691 -4.237 1730.483 111 TTT 17285.869 hecc 0.000 13M
-0.013 3.642 -192.866 -0.008 -0.008 1730.483 111 TTT 17285.869 hecc -0.000 13M
-0.225 2.382 -195.024 -4.509 -1.954 1730.483 111 TTT 17285.869 hecc 0.000 13M
-0.004 2.028 -194.558 -2.586 -1.709 1730.483 111 TTT 17285.869 hecc -0.000 13M
-0.295 1.816 -196.341 -0.999 -3.201 1730.483 111 TTT 17285.869 hecc -0.000 13M
-0.830 1.653 -197.812 0.033 -4.137 1730.483 111 TTT 17285.869 hecc -0.000 13M
-1.890 1.587 -198.589 0.599 -3.854 1730.483 111 TTT 17285.869 hecc -0.000 13M
-0.945 1.587 -198.348 0.730 -4.558 1730.483 111 TTT 17285.869 hecc -0.000 13M
-0.243 1.825 -196.487 0.342 -3.399 1730.483 111 TTT 17285.869 hecc -0.000 13M
-0.025 3.872 -192.878 -0.060 -0.007 1730.483 111 TTT 17285.869 hecc 0.000 13M
-1.117 0.924 -196.520 0.018 -2.558 1730.483 111 TTT 17285.869 hecc -0.000 13M
0.002 3.741 -192.846 -0.018 -0.003 1730.483 111 TTT 17285.869 hecc -0.000 13M
-0.299 2.030 -195.476 -3.363 -2.332 1730.483 111 TTT 17285.869 hecc 0.000 13M
-0.039 1.445 -195.497 -0.802 -2.613 1730.483 111 TTT 17285.869 hecc 0.000 13M
-0.349 1.126 -197.667 0.352 -4.474 1730.483 111 TTT 17285.869 hecc 0.000 13M
-1.248 0.945 -199.261 0.620 -5.168 1730.483 111 TTT 17285.869 hecc -0.000 13M
-3.124 0.958 -199.816 0.718 -3.847 1730.483 111 TTT 17285.869 hecc 0.000 13M
-1.533 1.094 -199.380 0.820 -5.003 1730.483 111 TTT 17285.869 hecc 0.000 13M
-0.424 1.440 -197.474 0.747 -4.205 1730.483 111 TTT 17285.869 hecc 0.000 13M
-0.013 3.613 -192.866 -0.010 -0.008 1730.483 111 TTT 17285.869 hecc 0.000 13M