element(s):
['Mg', 'Si']
AFLOW prototype label:
A2B_cF12_225_c_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.3505']
model name:
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Mg', 'Si']
representative atom coordinates =  [[0.25 0.25 0.25]
 [0.   0.   0.  ]]
spacegroup =  225
cell =  [[6.3505, 0, 0], [0, 6.3505, 0], [0, 0, 6.3505]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 00:13:51      -29.833255         0.578722
BFGS:    1 00:13:51      -29.847396         0.561538
BFGS:    2 00:13:52      -29.923954         0.459891
BFGS:    3 00:13:52      -29.985554         0.362072
BFGS:    4 00:13:53      -30.032762         0.267971
BFGS:    5 00:13:53      -30.066126         0.177477
BFGS:    6 00:13:54      -30.086180         0.090486
BFGS:    7 00:13:54      -30.093442         0.006894
BFGS:    8 00:13:55      -30.093485         0.000149
BFGS:    9 00:13:56      -30.093485         0.000000
BFGS:   10 00:13:56      -30.093485         0.000000
Minimization converged after 10 steps.
Maximum force component: 3.5764951131856563e-31 eV/Angstrom
Maximum stress component: 4.130092362747143e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Mg', 'Mg', 'Mg', 'Mg', 'Mg', 'Mg', 'Mg', 'Mg', 'Si', 'Si', 'Si', 'Si']
basis =  [[0.25 0.25 0.25]
 [0.75 0.75 0.25]
 [0.75 0.25 0.75]
 [0.25 0.75 0.75]
 [0.25 0.25 0.75]
 [0.75 0.75 0.75]
 [0.25 0.75 0.25]
 [0.75 0.25 0.25]
 [0.   1.   1.  ]
 [0.   0.5  0.5 ]
 [0.5  1.   0.5 ]
 [0.5  0.5  1.  ]]
cellpar =  Cell([[6.515868189740016, -2.7277057799934267e-32, -2.0893250111861437e-33], [-2.005500437642225e-32, 6.515868189740016, -6.221353315357903e-18], [-1.1938577423241601e-33, -6.221353315357905e-18, 6.515868189740016]])
forces =  [[-3.84839240e-32  1.23817843e-31 -1.59791945e-31]
 [-1.17124986e-32 -3.14564249e-31 -4.26669592e-32]
 [-1.67321409e-32  1.17124986e-31  1.02066059e-31]
 [ 2.67714254e-32 -2.76080325e-31  2.27557116e-31]
 [-2.84446395e-32  2.04132119e-31  8.58567979e-32]
 [ 1.18798200e-31 -2.62694612e-31  2.81936574e-31]
 [ 1.87399978e-31 -3.31296389e-31 -2.79426753e-31]
 [ 3.72290135e-32  2.07478547e-31 -3.57649511e-31]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]]
stress =  [-4.13009236e-13 -4.13009236e-13 -4.13009236e-13  1.43238934e-29
 -9.31932694e-63 -2.31583833e-61]
energy per atom =  -2.507790439573608
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0