element(s):
['Pd']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.9372']
model name:
EAM_Dynamo_SamolyukBelandStocks_2016_NiPd__MO_532072268679_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Pd']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[3.9372, 0, 0], [0, 3.9372, 0], [0, 0, 3.9372]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:35:23      -15.572274         0.775041
BFGS:    1 16:35:23      -15.596144         0.661034
BFGS:    2 16:35:23      -15.651625         0.052483
BFGS:    3 16:35:23      -15.651918         0.007447
BFGS:    4 16:35:23      -15.651924         0.000070
BFGS:    5 16:35:23      -15.651924         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.360933559405667e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Pd', 'Pd', 'Pd', 'Pd']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [2.42892987e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[3.8733649264217545, -7.034862851502992e-34, 1.8550303701229382e-33], [-1.1152767581154414e-33, 3.8733649264217545, 1.3019467499381685e-18], [-1.1138490980726772e-32, 1.3019467499381785e-18, 3.8733649264217545]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 3.36093356e-12  3.36093356e-12  3.36093356e-12 -9.89882220e-28
  1.19812031e-34 -3.32867666e-50]
energy per atom =  -3.5545651597470784
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0