element(s):
['W']
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:
['3.2041']
model name:
EAM_Dynamo_SetyawanGaoKurtz_2018_ReW__MO_680820064987_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['W']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[3.2041, 0, 0], [0, 3.2041, 0], [0, 0, 3.2041]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 18:13:20      -17.705101        1.6930
BFGS:    1 18:13:20      -17.788404        0.6113
BFGS:    2 18:13:20      -17.801276        0.0111
BFGS:    3 18:13:20      -17.801280        0.0007
BFGS:    4 18:13:20      -17.801280        0.0000
BFGS:    5 18:13:20      -17.801280        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 7.494598338701097e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['W', 'W']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.1430736095125194, -2.3363821148139082e-32, 4.492333642172634e-33], [-5.940378386924928e-33, 3.143073609512519, -4.64668985225393e-18], [-8.420694944957897e-33, -4.64668985225393e-18, 3.1430736095125194]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 7.49459834e-12  7.49459834e-12  7.49459834e-12  1.21308326e-28
 -2.59938206e-34 -5.16018734e-51]
energy per atom =  -8.90064009241227
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0