element(s):
['C']
AFLOW prototype label:
A_hP8_194_ef
Parameter names:
['a', 'c/a', 'z1', 'z2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.5188', '3.2978799', '0.092975226', '0.65554043']
model name:
MEAM_LAMMPS_KimLee_2008_TiC__MO_134206624109_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C']
representative atom coordinates =  [[0.         0.         0.09297523]
 [0.33333333 0.66666667 0.65554043]]
spacegroup =  194
cell =  [[2.5188, 0, 0], [-1.2594, 2.1813447870522, 0], [0, 0, 8.3067]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 14:47:43      -58.624144         3.195021
BFGS:    1 14:47:43      -58.626724         2.190542
BFGS:    2 14:47:43      -58.775603         0.904455
BFGS:    3 14:47:43      -58.791662         0.678801
BFGS:    4 14:47:43      -58.800951         0.348472
BFGS:    5 14:47:43      -58.802776         0.307359
BFGS:    6 14:47:43      -58.810452         0.055384
BFGS:    7 14:47:43      -58.810543         0.013321
BFGS:    8 14:47:43      -58.810557         0.006471
BFGS:    9 14:47:43      -58.810558         0.005962
BFGS:   10 14:47:43      -58.810563         0.003968
BFGS:   11 14:47:43      -58.810565         0.002683
BFGS:   12 14:47:43      -58.810565         0.000533
BFGS:   13 14:47:43      -58.810565         0.000043
BFGS:   14 14:47:43      -58.810565         0.000001
BFGS:   15 14:47:43      -58.810565         0.000000
BFGS:   16 14:47:43      -58.810565         0.000000
Minimization converged after 16 steps.
Maximum force component: 4.604043035705274e-09 eV/Angstrom
Maximum stress component: 2.0379054877808057e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[2.08983027e-35 5.66006365e-36 9.04661371e-02]
 [2.24911903e-35 1.05021007e-35 5.90466137e-01]
 [0.00000000e+00 0.00000000e+00 9.09533863e-01]
 [3.11076390e-35 1.82346552e-37 4.09533863e-01]
 [3.33333333e-01 6.66666667e-01 6.58174215e-01]
 [6.66666667e-01 3.33333333e-01 1.58174215e-01]
 [6.66666667e-01 3.33333333e-01 3.41825785e-01]
 [3.33333333e-01 6.66666667e-01 8.41825785e-01]]
cellpar =  Cell([[2.5140640278052975, -1.2428415870407593e-18, -7.79429203672718e-37], [-1.2570320139026487, 2.1772433148200143, 1.3578605005453205e-36], [1.291538174012611e-36, 6.55169686586115e-36, 8.24156142234759]])
forces =  [[-4.13176422e-32 -1.43128511e-31 -4.60404304e-09]
 [-7.21501307e-46 -3.66002178e-45 -4.60404304e-09]
 [ 7.74705791e-33 -1.34182979e-32  4.60404304e-09]
 [ 4.13176422e-32  1.78910639e-31  4.60404304e-09]
 [ 2.06588211e-31 -2.14692767e-31 -5.26722589e-10]
 [-1.03294105e-31 -3.57821278e-32 -5.26722589e-10]
 [-3.71858780e-31  2.14692767e-31  5.26722589e-10]
 [ 1.91094095e-31 -4.47276597e-32  5.26722589e-10]]
stress =  [ 2.03790549e-10  2.03790549e-10 -1.99449967e-10 -1.03037486e-32
  7.53523789e-33 -3.65801765e-27]
energy per atom =  -7.351320619333283
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0