ASE database

Displaying rows 526-550 out of 594
↓ ID ✕ Formula ✕ Username ✕ Maximum stress ✕ Maximum force ✕ PBC ✕ distance ✕ str_E ✕ Charge ✕
526 BeCu54 hecc 0.008 0.010 TTT 1.451 -195.504 0.000
527 Cu54B hecc 0.006 0.005 TTT 1.151 -197.683 0.000
528 Cu54C hecc 0.006 0.009 TTT 0.969 -199.306 0.000
529 Cu54N hecc 0.005 0.005 TTT 0.961 -199.897 0.000
530 Cu54O hecc 0.005 0.013 TTT 1.074 -199.470 0.000
531 Cu54F hecc 0.006 0.010 TTT 1.412 -197.506 0.000
532 Cu54Ne hecc 0.007 0.010 TTT 3.642 -192.866 0.000
533 Cu54Na hecc 0.008 0.006 TTT 2.382 -195.024 0.000
534 Cu54Mg hecc 0.007 0.008 TTT 2.028 -194.558 0.000
535 AlCu54 hecc 0.007 0.008 TTT 1.816 -196.341 0.000
536 Cu54Si hecc 0.006 0.010 TTT 1.653 -197.812 0.000
537 Cu54P hecc 0.006 0.010 TTT 1.587 -198.589 0.000
538 Cu54S hecc 0.006 0.008 TTT 1.587 -198.348 0.000
539 Cu54Cl hecc 0.006 0.009 TTT 1.825 -196.487 0.000
540 Cu54Ar hecc 0.007 0.011 TTT 3.872 -192.878 0.000
541 Cu54H hecc 0.007 0.009 TTT 0.924 -196.520 0.000
542 Cu54He hecc 0.007 0.009 TTT 3.741 -192.846 0.000
543 Cu54Li hecc 0.008 0.010 TTT 2.030 -195.476 0.000
544 BeCu54 hecc 0.007 0.010 TTT 1.445 -195.497 0.000
545 Cu54B hecc 0.006 0.005 TTT 1.126 -197.667 0.000
546 Cu54C hecc 0.005 0.009 TTT 0.945 -199.261 0.000
547 Cu54N hecc 0.005 0.009 TTT 0.958 -199.816 0.000
548 Cu54O hecc 0.006 0.010 TTT 1.094 -199.380 0.000
549 Cu54F hecc 0.006 0.010 TTT 1.440 -197.474 0.000
550 Cu54Ne hecc 0.007 0.010 TTT 3.613 -192.866 0.000