ASE database

ID Formula Charge Magnetic moment slab_E atom_E Maximum force
526 BeCu54 0.000 0.000 -192.845 -0.039 0.010
527 Cu54B 0.000 -0.000 -192.845 -0.349 0.005
528 Cu54C 0.000 -0.000 -192.845 -1.250 0.009
529 Cu54N 0.000 -0.000 -192.845 -3.120 0.005
530 Cu54O 0.000 -0.000 -192.845 -1.530 0.013
531 Cu54F 0.000 0.000 -192.845 -0.424 0.010
532 Cu54Ne 0.000 -0.000 -192.845 -0.013 0.010
533 Cu54Na 0.000 0.000 -192.845 -0.225 0.006
534 Cu54Mg 0.000 -0.000 -192.845 -0.004 0.008
535 AlCu54 0.000 -0.000 -192.845 -0.295 0.008
536 Cu54Si 0.000 -0.000 -192.845 -0.830 0.010
537 Cu54P 0.000 -0.000 -192.845 -1.890 0.010
538 Cu54S 0.000 -0.000 -192.845 -0.945 0.008
539 Cu54Cl 0.000 -0.000 -192.845 -0.243 0.009
540 Cu54Ar 0.000 0.000 -192.845 -0.025 0.011
541 Cu54H 0.000 -0.000 -192.845 -1.117 0.009
542 Cu54He 0.000 -0.000 -192.845 0.002 0.009
543 Cu54Li 0.000 0.000 -192.845 -0.299 0.010
544 BeCu54 0.000 0.000 -192.845 -0.039 0.010
545 Cu54B 0.000 0.000 -192.845 -0.349 0.005
546 Cu54C 0.000 -0.000 -192.845 -1.248 0.009
547 Cu54N 0.000 0.000 -192.845 -3.124 0.009
548 Cu54O 0.000 0.000 -192.845 -1.533 0.010
549 Cu54F 0.000 0.000 -192.845 -0.424 0.010
550 Cu54Ne 0.000 0.000 -192.845 -0.013 0.010