ASE database

ID Formula plane_index Energy Volume str_E Username Calculator
426 Cu54Mg 100 -191.772 1730.483 -191.772 hecc vasp
427 AlCu54 100 -193.507 1730.483 -193.507 hecc vasp
428 Cu54Si 100 -194.649 1730.483 -194.649 hecc vasp
429 Cu54P 100 -195.052 1730.483 -195.052 hecc vasp
430 Cu54S 100 -194.780 1730.483 -194.780 hecc vasp
431 Cu54Cl 100 -193.885 1730.483 -193.885 hecc vasp
432 Cu54Ar 100 -190.598 1730.483 -190.598 hecc vasp
433 Cu54H 100 -194.010 1730.483 -194.010 hecc vasp
434 Cu54He 100 -190.564 1730.483 -190.564 hecc vasp
435 Cu54Li 100 -192.948 1730.483 -192.948 hecc vasp
436 BeCu54 100 -192.689 1730.483 -192.689 hecc vasp
437 Cu54B 100 -194.711 1730.483 -194.711 hecc vasp
438 Cu54C 100 -196.228 1730.483 -196.228 hecc vasp
439 Cu54N 100 -196.860 1730.483 -196.860 hecc vasp
440 Cu54O 100 -196.683 1730.483 -196.683 hecc vasp
441 Cu54F 100 -195.308 1730.483 -195.308 hecc vasp
442 Cu54Ne 100 -190.583 1730.483 -190.583 hecc vasp
443 Cu54Na 100 -192.514 1730.483 -192.514 hecc vasp
444 Cu54Mg 100 -191.961 1730.483 -191.961 hecc vasp
445 AlCu54 100 -193.780 1730.483 -193.780 hecc vasp
446 Cu54Si 100 -195.179 1730.483 -195.179 hecc vasp
447 Cu54P 100 -195.849 1730.483 -195.849 hecc vasp
448 Cu54S 100 -195.639 1730.483 -195.639 hecc vasp
449 Cu54Cl 100 -194.232 1730.483 -194.232 hecc vasp
450 Cu54Ar 100 -190.597 1730.483 -190.597 hecc vasp