ASE database

ID Formula Volume Mass PBC Number of atoms Dipole_val Energy
551 Cu54Na 1730.483 3454.474 TTT 55 -4.502 -195.024
552 Cu54Mg 1730.483 3455.789 TTT 55 -2.595 -194.556
553 AlCu54 1730.483 3458.466 TTT 55 -1.006 -196.324
554 Cu54Si 1730.483 3459.569 TTT 55 0.043 -197.777
555 Cu54P 1730.483 3462.458 TTT 55 0.624 -198.547
556 Cu54S 1730.483 3463.544 TTT 55 0.764 -198.308
557 Cu54Cl 1730.483 3466.934 TTT 55 0.388 -196.481
558 Cu54Ar 1730.483 3471.432 TTT 55 -0.053 -192.878
559 Cu54H 1730.483 3432.492 TTT 55 0.014 -196.523
560 Cu54He 1730.483 3435.487 TTT 55 -0.017 -192.846
561 Cu54Li 1730.483 3438.424 TTT 55 -3.370 -195.466
562 BeCu54 1730.483 3440.496 TTT 55 -0.736 -195.474
563 Cu54B 1730.483 3442.294 TTT 55 0.322 -197.691
564 Cu54C 1730.483 3443.495 TTT 55 0.460 -199.256
565 Cu54N 1730.483 3445.491 TTT 55 0.716 -199.896
566 Cu54O 1730.483 3447.483 TTT 55 0.781 -199.469
567 Cu54F 1730.483 3450.482 TTT 55 0.687 -197.505
568 Cu54Ne 1730.483 3451.664 TTT 55 -0.008 -192.866
569 Cu54Na 1730.483 3454.474 TTT 55 -4.513 -195.018
570 Cu54Mg 1730.483 3455.789 TTT 55 -2.577 -194.540
571 AlCu54 1730.483 3458.466 TTT 55 -0.999 -196.341
572 Cu54Si 1730.483 3459.569 TTT 55 0.034 -197.812
573 Cu54P 1730.483 3462.458 TTT 55 0.602 -198.588
574 Cu54S 1730.483 3463.544 TTT 55 0.738 -198.347
575 Cu54Cl 1730.483 3466.934 TTT 55 0.581 -196.406