ASE database

Displaying rows 551-8 out of 8
↓ ID ✕ Formula ✕ plane_index ✕ Number of atoms ✕ ads_site ✕ Maximum stress ✕ distance ✕ PBC ✕ str_E ✕
551 Cu54Na 111 55 3h 0.008 2.376 TTT -195.024
552 Cu54Mg 111 55 3h 0.007 2.025 TTT -194.556
553 AlCu54 111 55 3h 0.007 1.820 TTT -196.324
554 Cu54Si 111 55 3h 0.006 1.670 TTT -197.777
555 Cu54P 111 55 3h 0.006 1.593 TTT -198.547
556 Cu54S 111 55 3h 0.006 1.602 TTT -198.308
557 Cu54Cl 111 55 3h 0.006 1.841 TTT -196.481
558 Cu54Ar 111 55 3h 0.007 3.920 TTT -192.878
559 Cu54H 111 55 1b 0.007 0.916 TTT -196.523
560 Cu54He 111 55 1b 0.007 3.776 TTT -192.846
561 Cu54Li 111 55 1b 0.008 2.025 TTT -195.466
562 BeCu54 111 55 1b 0.008 1.308 TTT -195.474
563 Cu54B 111 55 1b 0.008 0.834 TTT -197.691
564 Cu54C 111 55 1b 0.008 0.665 TTT -199.256
565 Cu54N 111 55 1b 0.005 0.958 TTT -199.896
566 Cu54O 111 55 1b 0.005 1.073 TTT -199.469
567 Cu54F 111 55 1b 0.006 1.409 TTT -197.505
568 Cu54Ne 111 55 1b 0.007 3.657 TTT -192.866
569 Cu54Na 111 55 1b 0.008 2.384 TTT -195.018
570 Cu54Mg 111 55 1b 0.008 1.991 TTT -194.540
571 AlCu54 111 55 1b 0.007 1.820 TTT -196.341
572 Cu54Si 111 55 1b 0.006 1.654 TTT -197.812
573 Cu54P 111 55 1b 0.006 1.585 TTT -198.588
574 Cu54S 111 55 1b 0.005 1.587 TTT -198.347
575 Cu54Cl 111 55 1b 0.006 1.895 TTT -196.406