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:
EAM_Dynamo_LiuAdams_1998_AlMg__MO_019873715786_000
==== 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 17:03:13       -5.578335        1.3236
BFGS:    1 17:03:14       -5.648915        1.1668
BFGS:    2 17:03:14       -5.795723        0.8022
BFGS:    3 17:03:14       -5.892853        0.5041
BFGS:    4 17:03:14       -5.950164        0.2702
BFGS:    5 17:03:14       -5.976814        0.0916
BFGS:    6 17:03:14       -5.980564        0.0053
BFGS:    7 17:03:14       -5.980576        0.0001
BFGS:    8 17:03:14       -5.980576        0.0000
BFGS:    9 17:03:14       -5.980576        0.0000
Minimization converged after 9 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 6.922239883442007e-11 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 6.83900085e-34 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.02585013e-33]]
cellpar =  Cell([[4.5057574624078445, -1.6925710000893565e-32, -4.004132938510787e-33], [-3.870465146723343e-33, 4.5057574624078445, 1.9439104886231237e-17], [1.8201138421577728e-33, 1.9439104886231222e-17, 4.5057574624078445]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-6.92223988e-11 -6.92223988e-11 -6.92223988e-11  1.54835629e-27
 -1.18580937e-36 -6.44990662e-54]
energy per atom =  -1.4951440712059905
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0