element(s):
['H']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.2058']
model name:
EAM_Dynamo_ZhouZimmermanWong_2008_PdH__MO_114797992931_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['H']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[4.2058, 0, 0], [0, 4.2058, 0], [0, 0, 4.2058]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:56:37       -0.617430        0.5521
BFGS:    1 17:56:37       -0.630626        0.5633
BFGS:    2 17:56:37       -0.720658        0.6384
BFGS:    3 17:56:38       -0.822495        0.7206
BFGS:    4 17:56:38       -0.937176        0.8095
BFGS:    5 17:56:38       -1.066328        0.9752
BFGS:    6 17:56:38       -1.255874        1.4691
BFGS:    7 17:56:38       -1.463035        1.2298
BFGS:    8 17:56:38       -1.656173        1.3448
BFGS:    9 17:56:38       -1.865825        1.4473
BFGS:   10 17:56:38       -2.088987        1.5219
BFGS:   11 17:56:38       -2.388507        2.5111
BFGS:   12 17:56:38       -2.735366        1.9863
BFGS:   13 17:56:38       -3.029865        1.7461
BFGS:   14 17:56:38       -3.260268        1.3471
BFGS:   15 17:56:38       -3.419284        0.7105
BFGS:   16 17:56:38       -3.459538        0.2036
BFGS:   17 17:56:38       -3.462130        0.0377
BFGS:   18 17:56:38       -3.462239        0.0041
BFGS:   19 17:56:38       -3.462241        0.0001
BFGS:   20 17:56:38       -3.462241        0.0000
BFGS:   21 17:56:38       -3.462241        0.0000
Minimization converged after 21 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 9.070506840298458e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['H', 'H']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.631362854238212, -2.2441590216613312e-32, 9.464108862535461e-33], [-4.226752873767277e-33, 2.6313628542382124, 1.3313288083262137e-17], [-3.219389578088726e-35, 1.3313288083262142e-17, 2.631362854238212]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 9.07050684e-13  9.07050684e-13  9.07050684e-13  1.33322443e-28
 -1.48346647e-34 -6.77579333e-51]
energy per atom =  -1.7280290899767874
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0