element(s):
['Al', 'Pd']
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:
['5.9161']
model name:
EAM_Dynamo_SchopfBrommerFrigan_2012_AlMnPd__MO_137572817842_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Pd']
representative atom coordinates =  [[0.25 0.25 0.25]
 [0.   0.   0.  ]]
spacegroup =  225
cell =  [[5.9161, 0, 0], [0, 5.9161, 0], [0, 0, 5.9161]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 15:12:26      -58.512453        0.2450
BFGS:    1 15:12:27      -58.514964        0.2333
BFGS:    2 15:12:27      -58.537365        0.0644
BFGS:    3 15:12:27      -58.539234        0.0016
BFGS:    4 15:12:27      -58.539235        0.0000
BFGS:    5 15:12:27      -58.539235        0.0000
BFGS:    6 15:12:27      -58.539235        0.0000
Minimization converged after 6 steps.
Maximum force component: 5.502411337058577e-32 eV/Angstrom
Maximum stress component: 4.59930587319978e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Pd', 'Pd', 'Pd', 'Pd']
basis =  [[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]
 [0.00000000e+00 7.50645205e-17 7.50645205e-17]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 7.50645205e-17 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 7.50645205e-17]]
cellpar =  Cell([[5.952115229119932, 2.7611367994315348e-33, 1.4478782668394937e-32], [-3.311782477667788e-33, 5.952115229119932, -3.698982382745958e-19], [2.1489758832966132e-33, -3.698982382745865e-19, 5.952115229119932]])
forces =  [[-1.06991332e-32  2.59836091e-32  1.29918045e-32]
 [ 1.83413711e-32  5.69918475e-52 -9.17068556e-33]
 [-3.19063435e-32  1.98698187e-32 -1.83413711e-32]
 [ 2.52193853e-32  3.82111898e-33  2.13982663e-32]
 [-3.05689519e-33 -2.13982663e-32  5.50241134e-32]
 [ 1.66218676e-32 -1.98698187e-32 -1.98698187e-32]
 [ 2.59836091e-32 -2.59836091e-32  1.26096926e-32]
 [ 2.82762805e-32  1.83413711e-32 -5.50241134e-32]
 [ 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 =  [-4.59930587e-15 -4.59930587e-15 -4.59930587e-15 -2.01887783e-30
  2.17449201e-35  2.26799270e-51]
energy per atom =  -4.8128631221734635
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0