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:
MEAM_LAMMPS_MaiselKoZhang_2017_VNiTi__MO_744610363128_002
==== 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 14:22:44      -14.367139         0.676113
BFGS:    1 14:22:44      -14.382043         0.579642
BFGS:    2 14:22:44      -14.418099         0.034091
BFGS:    3 14:22:44      -14.418124         0.029809
BFGS:    4 14:22:44      -14.418291         0.016811
BFGS:    5 14:22:44      -14.418364         0.015209
BFGS:    6 14:22:44      -14.418170         0.051780
BFGS:    7 14:22:44      -14.418395         0.007053
BFGS:    8 14:22:44      -14.418400         0.002573
BFGS:    9 14:22:44      -14.418401         0.000230
BFGS:   10 14:22:44      -14.418401         0.000126
BFGS:   11 14:22:44      -14.418401         0.000015
BFGS:   12 14:22:44      -14.418401         0.000001
BFGS:   13 14:22:44      -14.418401         0.000000
BFGS:   14 14:22:45      -14.418401         0.000000
Minimization converged after 14 steps.
Maximum force component: 5.726265337791026e-32 eV/Angstrom
Maximum stress component: 3.1680082214546905e-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([[4.6456983632108155, -3.691172405936459e-18, -8.949804638872904e-38], [-2.3228491816054078, 4.023292800860353, -2.2227963785816622e-37], [1.1518733791342796e-38, 1.2365889692671715e-36, 2.802841145973282]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [-5.72626534e-32  3.30606083e-32  2.87897370e-33]
 [ 3.57891584e-32 -2.06628802e-32 -2.87897370e-33]]
stress =  [-3.16800822e-11 -3.16800822e-11  3.77765548e-12  8.96293443e-35
 -1.60294000e-34 -2.72658016e-29]
energy per atom =  -4.806133561912269
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0