ASE database

Displaying rows 551-8 out of 8
Formula ✕ distance ✕ Mass ✕ Calculator ✕ Magnetic moment ✕ str_E ✕ Volume ✕ Maximum stress ✕ Energy ✕ ads_E ✕
Cu54Na 2.376 3454.474 vasp -0.000 -195.024 1730.483 0.008 -195.024 -1.954
Cu54Mg 2.025 3455.789 vasp -0.000 -194.556 1730.483 0.007 -194.556 -1.707
AlCu54 1.820 3458.466 vasp 0.000 -196.324 1730.483 0.007 -196.324 -3.184
Cu54Si 1.670 3459.569 vasp 0.000 -197.777 1730.483 0.006 -197.777 -4.102
Cu54P 1.593 3462.458 vasp 0.000 -198.547 1730.483 0.006 -198.547 -3.815
Cu54S 1.602 3463.544 vasp 0.000 -198.308 1730.483 0.006 -198.308 -4.518
Cu54Cl 1.841 3466.934 vasp -0.000 -196.481 1730.483 0.006 -196.481 -3.393
Cu54Ar 3.920 3471.432 vasp 0.000 -192.878 1730.483 0.007 -192.878 -0.008
Cu54H 0.916 3432.492 vasp -0.000 -196.523 1730.483 0.007 -196.523 -2.559
Cu54He 3.776 3435.487 vasp 0.000 -192.846 1730.483 0.007 -192.846 -0.003
Cu54Li 2.025 3438.424 vasp 0.000 -195.466 1730.483 0.008 -195.466 -2.322
BeCu54 1.308 3440.496 vasp -0.000 -195.474 1730.483 0.008 -195.474 -2.589
Cu54B 0.834 3442.294 vasp 0.000 -197.691 1730.483 0.008 -197.691 -4.498
Cu54C 0.665 3443.495 vasp 0.000 -199.256 1730.483 0.008 -199.256 -5.161
Cu54N 0.958 3445.491 vasp -0.000 -199.896 1730.483 0.005 -199.896 -3.931
Cu54O 1.073 3447.483 vasp -0.000 -199.469 1730.483 0.005 -199.469 -5.094
Cu54F 1.409 3450.482 vasp 0.000 -197.505 1730.483 0.006 -197.505 -4.236
Cu54Ne 3.657 3451.664 vasp 0.000 -192.866 1730.483 0.007 -192.866 -0.008
Cu54Na 2.384 3454.474 vasp -0.000 -195.018 1730.483 0.008 -195.018 -1.948
Cu54Mg 1.991 3455.789 vasp 0.000 -194.540 1730.483 0.008 -194.540 -1.691
AlCu54 1.820 3458.466 vasp 0.000 -196.341 1730.483 0.007 -196.341 -3.201
Cu54Si 1.654 3459.569 vasp -0.000 -197.812 1730.483 0.006 -197.812 -4.137
Cu54P 1.585 3462.458 vasp -0.000 -198.588 1730.483 0.006 -198.588 -3.853
Cu54S 1.587 3463.544 vasp -0.000 -198.347 1730.483 0.005 -198.347 -4.557
Cu54Cl 1.895 3466.934 vasp 0.000 -196.406 1730.483 0.006 -196.406 -3.318