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 16:02:29      -13.596301         0.756468
BFGS:    1 16:02:29      -13.614612         0.368652
BFGS:    2 16:02:29      -13.619985         0.024239
BFGS:    3 16:02:29      -13.620008         0.000262
BFGS:    4 16:02:29      -13.620008         0.000005
BFGS:    5 16:02:29      -13.620008         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.1254443601992569e-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, 3.3140309059258374e-34, 6.3709568057243155e-34], [2.3976263202572624e-34, 3.150153354906869, -3.6477194270834423e-22], [-7.476904493421535e-34, -3.647719427072848e-22, 3.1501533549068697]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.12544436e-10 -1.12544436e-10 -1.12544436e-10  1.51763676e-26
  1.03508454e-34 -9.53233362e-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