ASE database

ID Formula Charge Maximum stress Magnetic moment Energy Maximum force
551 Cu54Na 0.000 0.008 -0.000 -195.024 0.009
552 Cu54Mg 0.000 0.007 -0.000 -194.556 0.005
553 AlCu54 0.000 0.007 0.000 -196.324 0.008
554 Cu54Si 0.000 0.006 0.000 -197.777 0.009
555 Cu54P 0.000 0.006 0.000 -198.547 0.004
556 Cu54S 0.000 0.006 0.000 -198.308 0.009
557 Cu54Cl 0.000 0.006 -0.000 -196.481 0.009
558 Cu54Ar 0.000 0.007 0.000 -192.878 0.009
559 Cu54H 0.000 0.007 -0.000 -196.523 0.006
560 Cu54He 0.000 0.007 0.000 -192.846 0.006
561 Cu54Li 0.000 0.008 0.000 -195.466 0.007
562 BeCu54 0.000 0.008 -0.000 -195.474 0.009
563 Cu54B 0.000 0.008 0.000 -197.691 0.008
564 Cu54C 0.000 0.008 0.000 -199.256 0.010
565 Cu54N 0.000 0.005 -0.000 -199.896 0.008
566 Cu54O 0.000 0.005 -0.000 -199.469 0.007
567 Cu54F 0.000 0.006 0.000 -197.505 0.009
568 Cu54Ne 0.000 0.007 0.000 -192.866 0.007
569 Cu54Na 0.000 0.008 -0.000 -195.018 0.006
570 Cu54Mg 0.000 0.008 0.000 -194.540 0.010
571 AlCu54 0.000 0.007 0.000 -196.341 0.010
572 Cu54Si 0.000 0.006 -0.000 -197.812 0.010
573 Cu54P 0.000 0.006 -0.000 -198.588 0.006
574 Cu54S 0.000 0.005 -0.000 -198.347 0.008
575 Cu54Cl 0.000 0.006 0.000 -196.406 0.011