Enter the name of the KIM Model you wish to perform calculations for:
Enter the name of the species you wish to simulate:
Enter the lattice type of the crystal ('bcc', 'diamond', 'fcc', 'hcp', or 'sc'):
Enter the lattice constant 'a' in meters:
If the lattice type is hcp, enter the lattice constant 'c' in meters (if you are not using hcp as the lattice, simply put any value here, as it will be ignored):
Parameters Input: Be EAM_Dynamo_AgrawalMishraWard_2013_Be__MO_404563086984_000 hcp [2.612561490621903, 4.349100453546807]
Cell Size Min: 5
Cell Size Max: 7
Smallest System Size: 250
Largest System Size: 686

[Calculation]
Calculating Size 5 ...
[ERR1047]FIRE Failed: Steps Exceeds Maximum.
Vacancy Formation Energy May Not Be Accurate.
[ERR1047]FIRE Failed: Steps Exceeds Maximum.
Vacancy Formation Energy May Not Be Accurate.
       Step     Time          Energy         fmax
MDMin:    0 15:32:25  -334264.524778    17178.0669