ASE database

Displaying rows 551-575 out of 594
↓ ID ✕ Formula ✕ Age ✕ Magnetic moment ✕ Calculator ✕ Energy ✕ ads_site ✕ ads_E ✕
551 Cu54Na 15M -0.000 vasp -195.024 3h -1.954
552 Cu54Mg 15M -0.000 vasp -194.556 3h -1.707
553 AlCu54 15M 0.000 vasp -196.324 3h -3.184
554 Cu54Si 15M 0.000 vasp -197.777 3h -4.102
555 Cu54P 15M 0.000 vasp -198.547 3h -3.815
556 Cu54S 15M 0.000 vasp -198.308 3h -4.518
557 Cu54Cl 15M -0.000 vasp -196.481 3h -3.393
558 Cu54Ar 15M 0.000 vasp -192.878 3h -0.008
559 Cu54H 15M -0.000 vasp -196.523 1b -2.559
560 Cu54He 15M 0.000 vasp -192.846 1b -0.003
561 Cu54Li 15M 0.000 vasp -195.466 1b -2.322
562 BeCu54 15M -0.000 vasp -195.474 1b -2.589
563 Cu54B 15M 0.000 vasp -197.691 1b -4.498
564 Cu54C 15M 0.000 vasp -199.256 1b -5.161
565 Cu54N 15M -0.000 vasp -199.896 1b -3.931
566 Cu54O 15M -0.000 vasp -199.469 1b -5.094
567 Cu54F 15M 0.000 vasp -197.505 1b -4.236
568 Cu54Ne 15M 0.000 vasp -192.866 1b -0.008
569 Cu54Na 15M -0.000 vasp -195.018 1b -1.948
570 Cu54Mg 15M 0.000 vasp -194.540 1b -1.691
571 AlCu54 15M 0.000 vasp -196.341 1b -3.201
572 Cu54Si 15M -0.000 vasp -197.812 1b -4.137
573 Cu54P 15M -0.000 vasp -198.588 1b -3.853
574 Cu54S 15M -0.000 vasp -198.347 1b -4.557
575 Cu54Cl 15M 0.000 vasp -196.406 1b -3.318