element(s):
['Ti']
AFLOW prototype label:
A_hP3_191_ad
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.7179', '0.60942368']
model name:
EAM_Dynamo_FarkasJones_1996_NbTiAl__MO_042691367780_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ti', 'Ti']
representative atom coordinates =  [[0.         0.         0.        ]
 [0.33333333 0.66666667 0.5       ]]
spacegroup =  191
cell =  [[4.7179, 0, 0], [-2.35895, 4.0858212525146, 0], [0, 0, 2.8752]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 09:40:56      -14.406427        0.3020
BFGS:    1 09:40:56      -14.409605        0.2748
BFGS:    2 09:40:56      -14.422956        0.0964
BFGS:    3 09:40:56      -14.423221        0.1066
BFGS:    4 09:40:56      -14.423875        0.1023
BFGS:    5 09:40:56      -14.424439        0.0649
BFGS:    6 09:40:56      -14.424713        0.0168
BFGS:    7 09:40:56      -14.424746        0.0025
BFGS:    8 09:40:56      -14.424747        0.0002
BFGS:    9 09:40:56      -14.424747        0.0000
BFGS:   10 09:40:56      -14.424747        0.0000
BFGS:   11 09:40:56      -14.424747        0.0000
Minimization converged after 11 steps.
Maximum force component: 1.4263175652555915e-32 eV/Angstrom
Maximum stress component: 2.6843511875917333e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ti', 'Ti', 'Ti']
basis =  [[0.         0.         0.        ]
 [0.33333333 0.66666667 0.5       ]
 [0.66666667 0.33333333 0.5       ]]
cellpar =  Cell([[4.6286651333435325, 7.694153333727165e-18, -4.2174670415670194e-38], [-2.3143325666717662, 4.008541591086783, -1.823525791042985e-36], [-1.1044578535022768e-36, -4.8673316939811305e-36, 2.8665220618419065]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [-9.50878377e-33 -1.58062937e-50  8.66404914e-71]
 [ 1.42631757e-32 -8.23484830e-33 -2.30030028e-35]]
stress =  [ 2.68435119e-10  2.68435119e-10  1.21887487e-10  3.35219133e-35
  5.80616570e-35 -3.16409542e-26]
energy per atom =  -4.808249085761428
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0