ASE database

ID Formula Maximum stress str_E Age Calculator Maximum force Charge Username PBC
501 Cu72P 0.009 -258.140 15M vasp 0.007 0.000 hecc TTT
502 Cu72S 0.008 -257.602 15M vasp 0.005 0.000 hecc TTT
503 Cu72Cl 0.009 -255.817 15M vasp 0.009 0.000 hecc TTT
504 Cu72Ar 0.009 -252.163 15M vasp 0.011 0.000 hecc TTT
505 Cu72H 0.009 -255.116 15M vasp 0.006 0.000 hecc TTT
506 Cu72He 0.010 -252.122 15M vasp 0.009 0.000 hecc TTT
507 Cu72Li 0.010 -254.178 15M vasp 0.004 0.000 hecc TTT
508 BeCu72 0.009 -253.474 15M vasp 0.013 0.000 hecc TTT
509 Cu72B 0.010 -255.137 15M vasp 0.008 0.000 hecc TTT
510 Cu72C 0.010 -256.266 15M vasp 0.010 0.000 hecc TTT
511 Cu72N 0.010 -256.842 15M vasp 0.009 0.000 hecc TTT
512 Cu72O 0.009 -257.085 15M vasp 0.007 0.000 hecc TTT
513 Cu72F 0.009 -256.591 15M vasp 0.010 0.000 hecc TTT
514 Cu72Ne 0.010 -252.138 15M vasp 0.007 0.000 hecc TTT
515 Cu72Na 0.010 -253.859 15M vasp 0.009 0.000 hecc TTT
516 Cu72Mg 0.009 -253.063 15M vasp 0.006 0.000 hecc TTT
517 AlCu72 0.010 -254.732 15M vasp 0.010 0.000 hecc TTT
518 Cu72Si 0.010 -255.804 15M vasp 0.013 0.000 hecc TTT
519 Cu72P 0.010 -256.307 15M vasp 0.008 0.000 hecc TTT
520 Cu72S 0.009 -256.293 15M vasp 0.009 0.000 hecc TTT
521 Cu72Cl 0.009 -255.574 15M vasp 0.006 0.000 hecc TTT
522 Cu72Ar 0.010 -252.148 15M vasp 0.008 0.000 hecc TTT
523 Cu54H 0.007 -196.524 15M vasp 0.005 0.000 hecc TTT
524 Cu54He 0.007 -192.846 15M vasp 0.010 0.000 hecc TTT
525 Cu54Li 0.008 -195.478 15M vasp 0.006 0.000 hecc TTT