ASE database

ID Formula str_E atom_E slab_E Maximum stress
526 BeCu54 -195.504 -0.039 -192.845 0.008
527 Cu54B -197.683 -0.349 -192.845 0.006
528 Cu54C -199.306 -1.250 -192.845 0.006
529 Cu54N -199.897 -3.120 -192.845 0.005
530 Cu54O -199.470 -1.530 -192.845 0.005
531 Cu54F -197.506 -0.424 -192.845 0.006
532 Cu54Ne -192.866 -0.013 -192.845 0.007
533 Cu54Na -195.024 -0.225 -192.845 0.008
534 Cu54Mg -194.558 -0.004 -192.845 0.007
535 AlCu54 -196.341 -0.295 -192.845 0.007
536 Cu54Si -197.812 -0.830 -192.845 0.006
537 Cu54P -198.589 -1.890 -192.845 0.006
538 Cu54S -198.348 -0.945 -192.845 0.006
539 Cu54Cl -196.487 -0.243 -192.845 0.006
540 Cu54Ar -192.878 -0.025 -192.845 0.007
541 Cu54H -196.520 -1.117 -192.845 0.007
542 Cu54He -192.846 0.002 -192.845 0.007
543 Cu54Li -195.476 -0.299 -192.845 0.008
544 BeCu54 -195.497 -0.039 -192.845 0.007
545 Cu54B -197.667 -0.349 -192.845 0.006
546 Cu54C -199.261 -1.248 -192.845 0.005
547 Cu54N -199.816 -3.124 -192.845 0.005
548 Cu54O -199.380 -1.533 -192.845 0.006
549 Cu54F -197.474 -0.424 -192.845 0.006
550 Cu54Ne -192.866 -0.013 -192.845 0.007