element(s):
['H', 'Pd']
AFLOW prototype label:
AB_cF8_225_a_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.0996']
model name:
EAM_Dynamo_HaleWongZimmerman_2008PairMorse_PdAgH__MO_108983864770_005
==== Building ASE atoms object with: ====
representative atom symbols =  ['H', 'Pd']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[4.0996, 0, 0], [0, 4.0996, 0], [0, 0, 4.0996]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 12:10:48      -24.195108         1.260961
BFGS:    1 12:10:48      -24.260703         1.167068
BFGS:    2 12:10:48      -24.416586         0.907799
BFGS:    3 12:10:48      -24.533145         0.647267
BFGS:    4 12:10:48      -24.608870         0.366609
BFGS:    5 12:10:48      -24.644586         0.114834
BFGS:    6 12:10:48      -24.648847         0.010961
BFGS:    7 12:10:48      -24.648888         0.000434
BFGS:    8 12:10:48      -24.648888         0.000002
BFGS:    9 12:10:48      -24.648888         0.000000
Minimization converged after 9 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.3783497790067475e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['H', 'H', 'H', 'H', 'Pd', 'Pd', 'Pd', 'Pd']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [8.09872782e-50 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 8.09872782e-50 0.00000000e+00]
 [8.09872782e-50 5.00000000e-01 0.00000000e+00]
 [0.00000000e+00 2.27958923e-35 5.00000000e-01]]
cellpar =  Cell([[4.224291645521554, -3.554435132961106e-33, -1.0195648350550009e-33], [-2.9426469448949047e-33, 4.224291645521554, -1.4053582327075074e-18], [1.5109650121836977e-34, -1.4053582327075078e-18, 4.224291645521554]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-3.37834978e-11 -3.37834978e-11 -3.37834978e-11 -1.20534159e-28
  1.35709438e-60  2.68378559e-60]
energy per atom =  -3.081111012057628
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0