element(s):
['Ti']
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:
['3.397']
model name:
EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_Ti__MO_101966451181_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ti']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[3.397, 0, 0], [0, 3.397, 0], [0, 0, 3.397]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:12:47       -9.595904         1.065487
BFGS:    1 16:12:47       -9.639433         0.837262
BFGS:    2 16:12:47       -9.700021         0.068090
BFGS:    3 16:12:47       -9.700359         0.007918
BFGS:    4 16:12:47       -9.700364         0.000057
BFGS:    5 16:12:47       -9.700364         0.000000
BFGS:    6 16:12:47       -9.700364         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.6472338380277597e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ti', 'Ti']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.2919385502938896, 9.774482595572234e-33, 7.858417207980624e-34], [1.7664551507306427e-32, 3.291938550293891, -2.8210811397794968e-18], [-5.691236644392865e-34, -2.8210811397794952e-18, 3.2919385502938896]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.64723384e-14  1.64723384e-14  1.64723384e-14 -1.04083632e-31
 -9.47841618e-35  8.11090234e-52]
energy per atom =  -4.850181816311555
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0