ASE database

ID Formula Charge Maximum stress Magnetic moment Energy Maximum force
501 Cu72P 0.000 0.009 0.000 -258.140 0.007
502 Cu72S 0.000 0.008 0.000 -257.602 0.005
503 Cu72Cl 0.000 0.009 0.000 -255.817 0.009
504 Cu72Ar 0.000 0.009 0.000 -252.163 0.011
505 Cu72H 0.000 0.009 -0.000 -255.116 0.006
506 Cu72He 0.000 0.010 0.000 -252.122 0.009
507 Cu72Li 0.000 0.010 -0.000 -254.178 0.004
508 BeCu72 0.000 0.009 -0.000 -253.474 0.013
509 Cu72B 0.000 0.010 -0.000 -255.137 0.008
510 Cu72C 0.000 0.010 -0.000 -256.266 0.010
511 Cu72N 0.000 0.010 -0.006 -256.842 0.009
512 Cu72O 0.000 0.009 0.000 -257.085 0.007
513 Cu72F 0.000 0.009 0.000 -256.591 0.010
514 Cu72Ne 0.000 0.010 -0.000 -252.138 0.007
515 Cu72Na 0.000 0.010 -0.000 -253.859 0.009
516 Cu72Mg 0.000 0.009 -0.000 -253.063 0.006
517 AlCu72 0.000 0.010 -0.000 -254.732 0.010
518 Cu72Si 0.000 0.010 -0.000 -255.804 0.013
519 Cu72P 0.000 0.010 -0.000 -256.307 0.008
520 Cu72S 0.000 0.009 -0.000 -256.293 0.009
521 Cu72Cl 0.000 0.009 -0.000 -255.574 0.006
522 Cu72Ar 0.000 0.010 0.000 -252.148 0.008
523 Cu54H 0.000 0.007 -0.000 -196.524 0.005
524 Cu54He 0.000 0.007 -0.000 -192.846 0.010
525 Cu54Li 0.000 0.008 0.000 -195.478 0.006