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_Ackland_1992_Ti__MO_748534961139_005
==== 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 13:54:25      -14.289840        0.4333
BFGS:    1 13:54:25      -14.294865        0.3668
BFGS:    2 13:54:25      -14.306526        0.1209
BFGS:    3 13:54:25      -14.306755        0.1001
BFGS:    4 13:54:25      -14.307072        0.0635
BFGS:    5 13:54:25      -14.307395        0.0322
BFGS:    6 13:54:25      -14.307506        0.0141
BFGS:    7 13:54:25      -14.307522        0.0019
BFGS:    8 13:54:25      -14.307523        0.0002
BFGS:    9 13:54:25      -14.307523        0.0000
BFGS:   10 13:54:25      -14.307523        0.0000
BFGS:   11 13:54:25      -14.307523        0.0000
Minimization converged after 11 steps.
Maximum force component: 5.736280732622968e-32 eV/Angstrom
Maximum stress component: 7.048707247740076e-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([[4.653823816823765, 2.7349190622597636e-17, -7.3359340189503e-37], [-2.3269119084118826, 4.030329650106439, -2.353383941911782e-37], [-1.31955574069088e-38, -1.1148244706164676e-36, 2.8859198218338866]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [-3.82418716e-32 -2.24736534e-49  6.02815787e-69]
 [ 5.73628073e-32  3.37104801e-49 -9.04223680e-69]]
stress =  [-5.81265902e-11 -5.81265902e-11 -7.04870725e-11 -8.69880083e-37
 -1.50667650e-36 -1.67955107e-26]
energy per atom =  -4.769174256717112
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0