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_MasonNguyenManhBecquart_2017_W__MO_268730733493_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 16:26:39      -17.759795         1.167328
BFGS:    1 16:26:40      -17.795994         0.343099
BFGS:    2 16:26:40      -17.799973         0.031320
BFGS:    3 16:26:40      -17.800004         0.001552
BFGS:    4 16:26:40      -17.800004         0.000031
BFGS:    5 16:26:40      -17.800004         0.000000
BFGS:    6 16:26:40      -17.800004         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.5958198017292264e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['W', 'W']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.165197610341794, 2.6721902396165407e-33, 3.007870790424909e-34], [4.163041873185898e-33, 3.1651976103417936, 7.862844056656856e-22], [3.8856643121381275e-33, 7.862844056603087e-22, 3.165197610341794]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [3.59581980e-13 3.59581980e-13 3.59581980e-13 3.15265646e-29
 1.02526836e-34 9.63130030e-51]
energy per atom =  -8.900002089716597
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0