ASE database

ID Formula ads_E Mass plane_index Maximum force Dipole_val
501 Cu72P -4.158 4606.286 110 0.007 0.631
502 Cu72S -4.563 4607.372 110 0.005 0.628
503 Cu72Cl -3.480 4610.762 110 0.009 1.060
504 Cu72Ar -0.043 4615.260 110 0.011 -0.061
505 Cu72H -1.905 4576.320 110 0.006 0.728
506 Cu72He -0.029 4579.315 110 0.009 -0.030
507 Cu72Li -1.785 4582.252 110 0.004 -4.654
508 BeCu72 -1.340 4584.324 110 0.013 -0.984
509 Cu72B -2.695 4586.122 110 0.008 0.649
510 Cu72C -2.924 4587.323 110 0.010 1.506
511 Cu72N -1.624 4589.319 110 0.009 2.125
512 Cu72O -3.458 4591.311 110 0.007 2.704
513 Cu72F -4.073 4594.310 110 0.010 2.758
514 Cu72Ne -0.032 4595.492 110 0.007 -0.029
515 Cu72Na -1.541 4598.302 110 0.009 -5.698
516 Cu72Mg -0.965 4599.617 110 0.006 -2.721
517 AlCu72 -2.343 4602.294 110 0.010 -1.130
518 Cu72Si -2.880 4603.397 110 0.013 0.302
519 Cu72P -2.325 4606.286 110 0.008 1.317
520 Cu72S -3.255 4607.372 110 0.009 2.164
521 Cu72Cl -3.237 4610.762 110 0.006 2.539
522 Cu72Ar -0.028 4615.260 110 0.008 -0.149
523 Cu54H -2.559 3432.492 111 0.005 0.013
524 Cu54He -0.002 3435.487 111 0.010 -0.021
525 Cu54Li -2.334 3438.424 111 0.006 -3.352