ASE database

Displaying rows 101-125 out of 594
Formula ✕ Calculator ✕ Mass ✕ Maximum stress ✕ Energy ✕ Maximum force ✕
Au72Na vasp 14204.583 0.014 -220.823 0.009
Au72Mg vasp 14205.898 0.012 -220.273 0.008
AlAu72 vasp 14208.575 0.012 -222.069 0.007
Au72Si vasp 14209.678 0.012 -223.274 0.006
Au72P vasp 14212.567 0.013 -223.458 0.009
Au72S vasp 14213.653 0.013 -223.028 0.007
Au72Cl vasp 14217.043 0.013 -221.679 0.009
Au72Ar vasp 14221.541 0.013 -218.551 0.007
Au72H vasp 14182.601 0.013 -221.776 0.006
Au72He vasp 14185.596 0.013 -218.530 0.008
Au72Li vasp 14188.533 0.014 -221.011 0.008
Au72Be vasp 14190.605 0.013 -220.240 0.006
Au72B vasp 14192.403 0.013 -221.920 0.005
Au72C vasp 14193.604 0.013 -222.605 0.006
Au72N vasp 14195.600 0.013 -222.623 0.008
Au72O vasp 14197.592 0.013 -222.603 0.008
Au72F vasp 14200.591 0.012 -222.249 0.007
Au72Ne vasp 14201.773 0.013 -218.546 0.009
Au72Na vasp 14204.583 0.014 -220.649 0.009
Au72Mg vasp 14205.898 0.013 -219.792 0.009
AlAu72 vasp 14208.575 0.014 -221.476 0.010
Au72Si vasp 14209.678 0.014 -222.175 0.006
Au72P vasp 14212.567 0.013 -222.119 0.034
Au72S vasp 14213.653 0.013 -221.946 0.010
Au72Cl vasp 14217.043 0.012 -221.439 0.006