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_CuAgAuNiPdPtAlPbFeMoTaWMgCoTiZr__MO_870117231765_000
==== 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 14:46:38      -13.596301         0.756347
BFGS:    1 14:46:38      -13.614611         0.368941
BFGS:    2 14:46:38      -13.619983         0.024946
BFGS:    3 14:46:38      -13.620007         0.000725
BFGS:    4 14:46:38      -13.620007         0.000001
BFGS:    5 14:46:38      -13.620007         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.637686523953224e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Mo', 'Mo']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.150138287488182, -1.20622279294908e-32, 7.015781677491024e-34], [-3.0654375087882066e-32, 3.1501382874881814, -2.2508274012053863e-19], [4.6770774267016476e-33, -2.2508274012054817e-19, 3.150138287488182]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-4.63768652e-12 -4.63768652e-12 -4.63768652e-12  4.46206861e-28
  3.94629755e-34 -3.84107345e-50]
energy per atom =  -6.81000347789022
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Skipping parameter set 0 because of error while adding or validating property:
 
ERROR(@kim_property_modify): input value "Body-Centered Cubic" doesn't meet the format specification. An integer equal to or greater than 1 or integer indices range of "start:stop".
No parameter sets in this group successfully added a property instance. Skipping this group.