ASE database

Displaying rows 526-550 out of 594
↓ ID ✕ Formula ✕ distance ✕ PBC ✕ Charge ✕ Dipole_val ✕ Maximum stress ✕
526 BeCu54 1.451 TTT 0.000 -0.793 0.008
527 Cu54B 1.151 TTT 0.000 0.375 0.006
528 Cu54C 0.969 TTT 0.000 0.645 0.006
529 Cu54N 0.961 TTT 0.000 0.716 0.005
530 Cu54O 1.074 TTT 0.000 0.779 0.005
531 Cu54F 1.412 TTT 0.000 0.691 0.006
532 Cu54Ne 3.642 TTT 0.000 -0.008 0.007
533 Cu54Na 2.382 TTT 0.000 -4.509 0.008
534 Cu54Mg 2.028 TTT 0.000 -2.586 0.007
535 AlCu54 1.816 TTT 0.000 -0.999 0.007
536 Cu54Si 1.653 TTT 0.000 0.033 0.006
537 Cu54P 1.587 TTT 0.000 0.599 0.006
538 Cu54S 1.587 TTT 0.000 0.730 0.006
539 Cu54Cl 1.825 TTT 0.000 0.342 0.006
540 Cu54Ar 3.872 TTT 0.000 -0.060 0.007
541 Cu54H 0.924 TTT 0.000 0.018 0.007
542 Cu54He 3.741 TTT 0.000 -0.018 0.007
543 Cu54Li 2.030 TTT 0.000 -3.363 0.008
544 BeCu54 1.445 TTT 0.000 -0.802 0.007
545 Cu54B 1.126 TTT 0.000 0.352 0.006
546 Cu54C 0.945 TTT 0.000 0.620 0.005
547 Cu54N 0.958 TTT 0.000 0.718 0.005
548 Cu54O 1.094 TTT 0.000 0.820 0.006
549 Cu54F 1.440 TTT 0.000 0.747 0.006
550 Cu54Ne 3.613 TTT 0.000 -0.010 0.007