element(s):
['Al', 'Pt']
AFLOW prototype label:
AB_cP8_198_a_a
Parameter names:
['a', 'x1', 'x2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.8848', '0.84342988', '0.1552473']
model name:
EAM_Dynamo_ZhouJohnsonWadley_2004_CuAgAuNiPdPtAlPbFeMoTaWMgCoTiZr__MO_870117231765_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Pt']
representative atom coordinates =  [[0.84342988 0.84342988 0.84342988]
 [0.1552473  0.1552473  0.1552473 ]]
spacegroup =  198
cell =  [[4.8848, 0, 0], [0, 4.8848, 0], [0, 0, 4.8848]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 11:35:11      -34.798452         0.708882
BFGS:    1 11:35:11      -34.830065         0.647266
BFGS:    2 11:35:11      -34.948444         0.363207
BFGS:    3 11:35:11      -35.005146         0.108887
BFGS:    4 11:35:11      -35.010864         0.017906
BFGS:    5 11:35:12      -35.010890         0.016864
BFGS:    6 11:35:12      -35.010979         0.005787
BFGS:    7 11:35:12      -35.010989         0.001537
BFGS:    8 11:35:12      -35.010990         0.000486
BFGS:    9 11:35:12      -35.010990         0.000374
BFGS:   10 11:35:12      -35.010990         0.000360
BFGS:   11 11:35:12      -35.010990         0.000234
BFGS:   12 11:35:12      -35.010990         0.000077
BFGS:   13 11:35:12      -35.010990         0.000022
BFGS:   14 11:35:12      -35.010990         0.000003
BFGS:   15 11:35:12      -35.010990         0.000000
BFGS:   16 11:35:12      -35.010990         0.000000
Minimization converged after 16 steps.
Maximum force component: 2.9909945486365227e-09 eV/Angstrom
Maximum stress component: 1.5594064374042598e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Al', 'Pt', 'Pt', 'Pt', 'Pt']
basis =  [[0.85021588 0.85021588 0.85021588]
 [0.64978412 0.14978412 0.35021588]
 [0.14978412 0.35021588 0.64978412]
 [0.35021588 0.64978412 0.14978412]
 [0.14792066 0.14792066 0.14792066]
 [0.35207934 0.85207934 0.64792066]
 [0.85207934 0.64792066 0.35207934]
 [0.64792066 0.35207934 0.85207934]]
cellpar =  Cell([4.96586119729677, 4.96586119729677, 4.96586119729677])
forces =  [[ 4.45866113e-11  4.45866113e-11  4.45866113e-11]
 [-4.45866113e-11 -4.45866113e-11  4.45866113e-11]
 [-4.45866113e-11  4.45866113e-11 -4.45866113e-11]
 [ 4.45866113e-11 -4.45866113e-11 -4.45866113e-11]
 [ 2.99099455e-09  2.99099455e-09  2.99099455e-09]
 [-2.99099455e-09 -2.99099455e-09  2.99099455e-09]
 [-2.99099455e-09  2.99099455e-09 -2.99099455e-09]
 [ 2.99099455e-09 -2.99099455e-09 -2.99099455e-09]]
stress =  [1.55940644e-10 1.55940644e-10 1.55940644e-10 0.00000000e+00
 0.00000000e+00 0.00000000e+00]
energy per atom =  -4.376373731547137
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0