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_AhmadGrohGhazisaeidi_2018_MgY__MO_135739722270_002
==== 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 16:24:14       -5.643002         1.143493
BFGS:    1 16:24:14       -5.696556         1.042714
BFGS:    2 16:24:14       -5.831131         0.757237
BFGS:    3 16:24:14       -5.925337         0.503964
BFGS:    4 16:24:15       -5.983782         0.279955
BFGS:    5 16:24:15       -6.010651         0.082513
BFGS:    6 16:24:15       -6.013444         0.007274
BFGS:    7 16:24:15       -6.013467         0.000217
BFGS:    8 16:24:15       -6.013467         0.000001
BFGS:    9 16:24:15       -6.013467         0.000000
Minimization converged after 9 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.2553650062882907e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Mg', 'Mg', 'Mg', 'Mg']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.71249044e-34 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[4.498547604215366, -9.944222083490545e-34, -1.5029042614425276e-33], [-1.7727456482340706e-33, 4.498547604215366, -7.376194685256064e-18], [-2.0225335710416637e-33, -7.376194685256065e-18, 4.498547604215366]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.25536501e-12 -2.25536501e-12 -2.25536501e-12 -2.81514200e-28
  0.00000000e+00 -8.18668163e-62]
energy per atom =  -1.5033667114691955
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0