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_SunMendelevBecker_2006_Mg__MO_848345414202_005
==== 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 17:03:14       -5.821149        0.7034
BFGS:    1 17:03:14       -5.841621        0.6558
BFGS:    2 17:03:14       -5.926072        0.4856
BFGS:    3 17:03:14       -5.989957        0.3690
BFGS:    4 17:03:14       -6.036484        0.2477
BFGS:    5 17:03:14       -6.062670        0.0952
BFGS:    6 17:03:14       -6.066356        0.0188
BFGS:    7 17:03:14       -6.066495        0.0009
BFGS:    8 17:03:14       -6.066495        0.0000
BFGS:    9 17:03:14       -6.066495        0.0000
Minimization converged after 9 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.3401453102050308e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Mg', 'Mg', 'Mg', 'Mg']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [3.42462109e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.71368025e-34]]
cellpar =  Cell([[4.495424258297103, -3.595041484142173e-32, 2.718394296195265e-32], [-2.2199141589506166e-33, 4.495424258297103, -9.339845330003806e-18], [-2.1335234161556893e-34, -9.339845330003803e-18, 4.495424258297103]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.34014531e-11 -1.34014531e-11 -1.34014531e-11  6.11577777e-28
  3.97089016e-37 -3.25363016e-53]
energy per atom =  -1.5166237398225564
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0