element(s):
['Mg']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.2446']
model name:
MEAM_LAMMPS_KimKimLee_2009_AlMg__MO_058537087384_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Mg']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[4.2446, 0, 0], [0, 4.2446, 0], [0, 0, 4.2446]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:18:53       -5.692584         1.321869
BFGS:    1 15:18:53       -5.763942         1.198198
BFGS:    2 15:18:54       -5.920537         0.895582
BFGS:    3 15:18:54       -6.034290         0.626447
BFGS:    4 15:18:54       -6.109993         0.387771
BFGS:    5 15:18:54       -6.152005         0.176780
BFGS:    6 15:18:54       -6.164159         0.019455
BFGS:    7 15:18:54       -6.164319         0.001157
BFGS:    8 15:18:54       -6.164319         0.000008
BFGS:    9 15:18:54       -6.164319         0.000000
Minimization converged after 9 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.6404174849835617e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Mg', 'Mg', 'Mg', 'Mg']
basis =  [[0.0000000e+00 0.0000000e+00 0.0000000e+00]
 [0.0000000e+00 5.0000000e-01 5.0000000e-01]
 [5.0000000e-01 0.0000000e+00 5.0000000e-01]
 [5.0000000e-01 5.0000000e-01 1.7016633e-34]]
cellpar =  Cell([[4.527170419981333, 2.6011165865400337e-33, 1.0595463626443215e-34], [7.392254928652989e-33, 4.527170419981333, 8.616667692695506e-18], [-1.0955545130594186e-34, 8.616667692695504e-18, 4.527170419981333]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.64041748e-10 -1.64041748e-10 -1.64041748e-10 -5.51381199e-29
 -1.01800264e-35 -2.16910276e-53]
energy per atom =  -1.5410798567680186
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0