element(s):
['Mo']
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:
['3.1827']
model name:
EAM_Dynamo_ZhouJohnsonWadley_2004_Mo__MO_271256517527_005
==== Building ASE atoms object with: ====
representative atom symbols =  ['Mo']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[3.1827, 0, 0], [0, 3.1827, 0], [0, 0, 3.1827]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 18:00:26      -13.596301        0.7565
BFGS:    1 18:00:26      -13.614612        0.3687
BFGS:    2 18:00:26      -13.619985        0.0242
BFGS:    3 18:00:26      -13.620008        0.0003
BFGS:    4 18:00:26      -13.620008        0.0000
BFGS:    5 18:00:26      -13.620008        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.1254443601992552e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Mo', 'Mo']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.1501533549068697, -3.262537972018369e-33, 3.3169422322728894e-33], [-1.3049003434723648e-33, 3.150153354906869, -2.9316068780541483e-19], [2.512248052213419e-33, -2.9316068780541415e-19, 3.1501533549068697]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.12544436e-10 -1.12544436e-10 -1.12544436e-10 -1.92691680e-26
  1.03508454e-34  4.06460332e-51]
energy per atom =  -6.810002873052596
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0