element(s):
['Al', 'Pt']
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:
['5.9136']
model name:
EMT_Asap_Standard_JacobsenStoltzeNorskov_1996_AlAgAuCuNiPdPt__MO_115316750986_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Pt']
representative atom coordinates =  [[0.25 0.25 0.25]
 [0.   0.   0.  ]]
spacegroup =  225
cell =  [[5.9136, 0, 0], [0, 5.9136, 0], [0, 0, 5.9136]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 17:06:57      -41.391504         2.629071
BFGS:    1 17:06:57      -41.680778         2.505982
BFGS:    2 17:06:57      -42.044592         2.345497
BFGS:    3 17:06:57      -42.384605         2.188565
BFGS:    4 17:06:58      -42.701317         2.034726
BFGS:    5 17:06:58      -42.995146         1.883352
BFGS:    6 17:06:58      -43.266405         1.733630
BFGS:    7 17:06:58      -43.515272         1.584644
BFGS:    8 17:06:59      -43.741799         1.435711
BFGS:    9 17:06:59      -43.945999         1.287128
BFGS:   10 17:06:59      -44.128068         1.141243
BFGS:   11 17:06:59      -44.288748         1.002902
BFGS:   12 17:07:00      -44.429593         0.877516
BFGS:   13 17:07:00      -44.552747         0.766795
BFGS:   14 17:07:00      -44.660144         0.666186
BFGS:   15 17:07:01      -44.752690         0.567343
BFGS:   16 17:07:01      -44.830047         0.462611
BFGS:   17 17:07:01      -44.890926         0.347013
BFGS:   18 17:07:02      -44.933467         0.217796
BFGS:   19 17:07:02      -44.955538         0.074157
BFGS:   20 17:07:02      -44.958235         0.004962
BFGS:   21 17:07:02      -44.958247         0.000078
BFGS:   22 17:07:03      -44.958247         0.000000
BFGS:   23 17:07:03      -44.958247         0.000000
Minimization converged after 23 steps.
Maximum force component: 3.4773657399472843e-31 eV/Angstrom
Maximum stress component: 4.853078798223408e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Pt', 'Pt', 'Pt', 'Pt']
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]
 [1.42710814e-64 1.00000000e+00 1.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.00000000e+00]]
cellpar =  Cell([[6.387564342277684, -3.1391631935811894e-32, 2.067137422203654e-32], [-5.856480271142313e-33, 6.387564342277684, 1.7707020750028093e-20], [-2.1347531117642025e-32, 1.7707020750048168e-20, 6.387564342277684]])
forces =  [[ 5.24885395e-32  3.47736574e-31 -5.86395402e-32]
 [ 2.62442697e-32 -3.29693639e-31 -5.90496069e-32]
 [ 7.21717418e-32  2.69003765e-31 -4.59274720e-32]
 [ 1.18099214e-31 -2.75564832e-31  3.28053372e-32]
 [ 2.36198428e-31  1.90270956e-31 -4.75677389e-32]
 [-4.39904620e-64 -1.18099214e-31  1.64026686e-31]
 [-5.24885395e-32 -7.21717418e-32 -1.37782416e-31]
 [ 2.36198428e-31  1.27940815e-31  1.88630689e-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 =  [ 4.85307880e-14  4.85307880e-14  4.85307880e-14 -9.74759690e-32
 -2.01399610e-34  1.87099323e-51]
energy per atom =  -3.7465206089389618
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0