element(s):
['Cu', 'Mg']
AFLOW prototype label:
A2B_cF24_227_c_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['7.0329']
model name:
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cu', 'Mg']
representative atom coordinates =  [[0.125 0.125 0.125]
 [0.5   0.5   0.5  ]]
spacegroup =  227
cell =  [[7.0329, 0, 0], [0, 7.0329, 0], [0, 0, 7.0329]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:56:11      -72.082554         0.001705
BFGS:    1 16:56:12      -72.082555         0.001676
BFGS:    2 16:56:12      -72.082558         0.000001
BFGS:    3 16:56:13      -72.082558         0.000000
Minimization converged after 3 steps.
Maximum force component: 8.488629168958767e-32 eV/Angstrom
Maximum stress component: 1.2011037590130009e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Mg', 'Mg', 'Mg', 'Mg', 'Mg', 'Mg', 'Mg', 'Mg']
basis =  [[1.25000000e-01 1.25000000e-01 1.25000000e-01]
 [8.75000000e-01 3.75000000e-01 6.25000000e-01]
 [3.75000000e-01 6.25000000e-01 8.75000000e-01]
 [6.25000000e-01 8.75000000e-01 3.75000000e-01]
 [3.75000000e-01 8.75000000e-01 6.25000000e-01]
 [8.75000000e-01 6.25000000e-01 3.75000000e-01]
 [6.25000000e-01 3.75000000e-01 8.75000000e-01]
 [1.25000000e-01 6.25000000e-01 6.25000000e-01]
 [8.75000000e-01 8.75000000e-01 1.25000000e-01]
 [3.75000000e-01 1.25000000e-01 3.75000000e-01]
 [3.75000000e-01 3.75000000e-01 1.25000000e-01]
 [8.75000000e-01 1.25000000e-01 8.75000000e-01]
 [6.25000000e-01 1.25000000e-01 6.25000000e-01]
 [1.25000000e-01 8.75000000e-01 8.75000000e-01]
 [1.25000000e-01 3.75000000e-01 3.75000000e-01]
 [6.25000000e-01 6.25000000e-01 1.25000000e-01]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.57861341e-17 1.00000000e+00]
 [1.00000000e+00 1.57861341e-17 5.00000000e-01]
 [1.00000000e+00 5.00000000e-01 1.00000000e+00]
 [2.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 7.50000000e-01 7.50000000e-01]
 [7.50000000e-01 2.50000000e-01 2.50000000e-01]
 [2.50000000e-01 2.50000000e-01 7.50000000e-01]]
cellpar =  Cell([7.03332168626357, 7.03332168626357, 7.03332168626357])
forces =  [[ 9.48197939e-33  1.08365479e-32  1.08365479e-32]
 [-3.61218263e-33  2.52852784e-32 -2.70913697e-33]
 [ 2.48337555e-32 -4.96675111e-33  1.98670044e-32]
 [ 2.16730958e-32  3.07035523e-32  1.44487305e-32]
 [-1.80609131e-33  0.00000000e+00 -1.35456848e-33]
 [ 0.00000000e+00  1.08365479e-32  1.26426392e-32]
 [ 7.22436525e-33  1.08365479e-32 -1.08365479e-32]
 [ 1.44487305e-32  9.70774080e-33 -1.80609131e-33]
 [-1.26426392e-32 -2.16730958e-32  3.61218263e-33]
 [ 3.61218263e-33 -1.08365479e-32  1.26426392e-32]
 [-1.44487305e-32 -1.26426392e-32  0.00000000e+00]
 [ 2.16730958e-32  7.22436525e-33  1.44487305e-32]
 [ 1.44487305e-32  7.22436525e-33 -4.51522828e-33]
 [ 1.44487305e-32  4.96675111e-32  1.26426392e-32]
 [-7.22436525e-33  3.61218263e-33  4.51522828e-33]
 [ 5.41827394e-33  7.22436525e-33  1.80609131e-32]
 [ 2.12215729e-32 -4.87644654e-32 -2.16730958e-32]
 [-7.22436525e-33  6.32131959e-32  4.51522828e-34]
 [-4.33461915e-32  7.22436525e-33 -5.41827394e-33]
 [ 3.16065980e-32 -5.41827394e-32 -6.14071046e-32]
 [-5.21508866e-32 -5.01190339e-32 -1.08365479e-32]
 [ 4.33461915e-32  7.22436525e-32  6.32131959e-32]
 [-6.32131959e-32 -8.48862917e-32 -4.69583741e-32]
 [-3.61218263e-32  3.61218263e-33  1.35456848e-32]]
stress =  [-1.20110376e-11 -1.20110376e-11 -1.20110376e-11 -2.07643457e-35
 -5.19108643e-35  0.00000000e+00]
energy per atom =  -3.0034399193744723
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0