element(s):
['Al', 'Ni']
AFLOW prototype label:
AB3_cF16_225_a_bc
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.6016']
model name:
MEAM_LAMMPS_CostaAgrenClavaguera_2007_AlNi__MO_131642768288_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Ni', 'Ni']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.5  0.5  0.5 ]
 [0.25 0.25 0.25]]
spacegroup =  225
cell =  [[5.6016, 0, 0], [0, 5.6016, 0], [0, 0, 5.6016]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 12:16:52      -72.620475         0.243925
BFGS:    1 12:16:52      -72.622980         0.235331
BFGS:    2 12:16:52      -72.649150         0.114307
BFGS:    3 12:16:52      -72.657476         0.003850
BFGS:    4 12:16:52      -72.657486         0.000066
BFGS:    5 12:16:52      -72.657486         0.000000
BFGS:    6 12:16:52      -72.657486         0.000000
Minimization converged after 6 steps.
Maximum force component: 2.0324910133766542e-30 eV/Angstrom
Maximum stress component: 3.5204666865910266e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Al', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 6.06859834e-50 1.21371967e-49]
 [0.00000000e+00 5.00000000e-01 0.00000000e+00]
 [0.00000000e+00 0.00000000e+00 5.00000000e-01]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]
 [2.50000000e-01 2.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 2.50000000e-01]]
cellpar =  Cell([[5.6374448203824095, -4.238072156067981e-33, -8.997879203199032e-33], [7.283421465904191e-33, 5.6374448203824095, 8.499629803505588e-20], [-2.352085804883959e-33, 8.499629803505727e-20, 5.6374448203824095]])
forces =  [[ 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]
 [ 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]
 [-1.15811454e-32 -4.28502379e-31  1.98037586e-30]
 [-5.76161982e-31  2.83738062e-31  1.60398863e-30]
 [-2.07012974e-31 -3.93758943e-31 -1.98037586e-30]
 [-5.44313833e-31  1.73717181e-32 -1.22760141e-30]
 [ 4.28502379e-31 -7.41193304e-31 -1.64452264e-30]
 [-8.68585903e-33 -2.89528634e-32 -1.93405128e-30]
 [ 4.63245815e-32  2.08460617e-31  1.69084722e-30]
 [ 6.94868723e-31 -9.72816212e-31  2.03249101e-30]]
stress =  [-3.52046669e-14 -3.52046669e-14 -3.52046669e-14  1.98084123e-29
  4.20163148e-34 -2.22710652e-50]
energy per atom =  -4.541092871220042
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0