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_2004NISTretabulation_Mo__MO_230319944007_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 16:14:28      -13.596301         0.756347
BFGS:    1 16:14:28      -13.614611         0.368942
BFGS:    2 16:14:28      -13.619983         0.024946
BFGS:    3 16:14:28      -13.620007         0.000725
BFGS:    4 16:14:28      -13.620007         0.000001
BFGS:    5 16:14:28      -13.620007         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.6943258675690834e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Mo', 'Mo']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.150138285507119, -2.4782290341809857e-32, 4.6536989797290555e-33], [-3.2611248098984766e-34, 3.1501382855071185, -6.016807681774765e-20], [-2.5051933004666663e-33, -6.016807681774769e-20, 3.150138285507119]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-4.69432587e-12 -4.69432587e-12 -4.69432587e-12  1.92474205e-28
 -1.03509444e-34  7.01192203e-51]
energy per atom =  -6.810003469350168
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0