ASE database

ID Formula atom_E ads_E Mass Dipole_val Maximum force plane_index
576 Cu54Ar -0.025 -0.009 3471.432 -0.041 0.012 111
577 Cu54H -1.117 -1.923 3432.492 0.281 0.006 111
578 Cu54He 0.002 -0.003 3435.487 -0.019 0.009 111
579 Cu54Li -0.299 -2.222 3438.424 -3.579 0.008 111
580 BeCu54 -0.039 -1.956 3440.496 -0.919 0.008 111
581 Cu54B -0.349 -3.063 3442.294 0.323 0.011 111
582 Cu54C -1.248 -3.219 3443.495 0.960 0.009 111
583 Cu54N -3.124 -1.739 3445.491 1.474 0.479 111
584 Cu54O -1.533 -3.329 3447.483 1.815 0.007 111
585 Cu54F -0.424 -3.771 3450.482 1.950 0.010 111
586 Cu54Ne -0.013 -0.007 3451.664 -0.016 0.009 111
587 Cu54Na -0.225 -1.898 3454.474 -4.587 0.009 111
588 Cu54Mg -0.004 -1.504 3455.789 -2.541 0.008 111
589 AlCu54 -0.295 -2.799 3458.466 -0.969 0.007 111
590 Cu54Si -0.830 -3.467 3459.569 0.022 0.008 111
591 Cu54P -1.888 -2.813 3462.458 0.571 0.008 111
592 Cu54S -0.945 -3.363 3463.544 1.109 0.009 111
593 Cu54Cl -0.243 -2.991 3466.934 1.499 0.008 111
594 Cu54Ar -0.025 -0.007 3471.432 -0.070 0.010 111