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_ZhouJohnsonWadley_2004NISTretabulation_Ti__MO_101966451181_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 14:19:52      -14.378613         0.392078
BFGS:    1 14:19:52      -14.381226         0.345015
BFGS:    2 14:19:52      -14.388495         0.074314
BFGS:    3 14:19:52      -14.388653         0.059740
BFGS:    4 14:19:52      -14.389142         0.033991
BFGS:    5 14:19:52      -14.389222         0.011659
BFGS:    6 14:19:52      -14.389230         0.001146
BFGS:    7 14:19:52      -14.389230         0.000111
BFGS:    8 14:19:52      -14.389230         0.000003
BFGS:    9 14:19:52      -14.389230         0.000000
BFGS:   10 14:19:52      -14.389230         0.000000
Minimization converged after 10 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.175956054625298e-11 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([[4.709036426337498, 1.0127656553305027e-18, 1.3771411583444851e-36], [-2.354518213168749, 4.078145172554562, 1.2237037141964304e-36], [1.1846354408689412e-36, 9.232931303725337e-37, 2.828668054716223]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.17595605e-11 -2.17595605e-11 -1.90238148e-11  4.89730594e-34
  7.76170872e-48  8.35253386e-27]
energy per atom =  -4.796410010141349
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0