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_KimJungLee_2009_FeTiC__MO_110119204723_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 19:46:15      -58.624144         3.195021
BFGS:    1 19:46:15      -58.626724         2.190542
BFGS:    2 19:46:15      -58.775603         0.904456
BFGS:    3 19:46:15      -58.791661         0.678804
BFGS:    4 19:46:15      -58.800951         0.348472
BFGS:    5 19:46:15      -58.802776         0.307359
BFGS:    6 19:46:15      -58.810452         0.055386
BFGS:    7 19:46:15      -58.810543         0.013320
BFGS:    8 19:46:15      -58.810557         0.006471
BFGS:    9 19:46:15      -58.810558         0.005962
BFGS:   10 19:46:15      -58.810563         0.003967
BFGS:   11 19:46:15      -58.810565         0.002682
BFGS:   12 19:46:15      -58.810565         0.000533
BFGS:   13 19:46:15      -58.810565         0.000043
BFGS:   14 19:46:15      -58.810565         0.000001
BFGS:   15 19:46:15      -58.810565         0.000000
BFGS:   16 19:46:15      -58.810565         0.000000
Minimization converged after 16 steps.
Maximum force component: 4.6103310058498445e-09 eV/Angstrom
Maximum stress component: 2.041354173009338e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[0.00000000e+00 0.00000000e+00 9.04661412e-02]
 [0.00000000e+00 4.97961409e-35 5.90466141e-01]
 [0.00000000e+00 7.49349615e-35 9.09533859e-01]
 [2.87824242e-35 1.00288696e-36 4.09533859e-01]
 [3.33333333e-01 6.66666667e-01 6.58174217e-01]
 [6.66666667e-01 3.33333333e-01 1.58174217e-01]
 [6.66666667e-01 3.33333333e-01 3.41825783e-01]
 [3.33333333e-01 6.66666667e-01 8.41825783e-01]]
cellpar =  Cell([[2.5140639852725646, -4.304507344655308e-19, -2.580732560773306e-37], [-1.2570319926362823, 2.1772432779855864, -1.2770403290722964e-37], [-1.3598248913220944e-36, 1.1189233374793899e-35, 8.241561422776856]])
forces =  [[ 4.95811698e-31 -1.43128509e-31 -4.61033101e-09]
 [-4.13176415e-31  4.29385526e-31 -4.61033101e-09]
 [-1.54941156e-31  1.25237445e-31  4.61033101e-09]
 [ 5.78446981e-31 -7.15642543e-31  4.61033101e-09]
 [ 1.65270566e-31 -7.09512640e-46 -5.22579036e-10]
 [-1.23952924e-31  7.15642543e-32 -5.22579036e-10]
 [ 1.03294104e-31 -1.78910636e-31  5.22579036e-10]
 [ 1.35573511e-31 -2.34820209e-31  5.22579036e-10]]
stress =  [ 2.04135417e-10  2.04135417e-10 -1.99858761e-10 -1.93751533e-44
 -6.59441403e-45 -2.79877081e-26]
energy per atom =  -7.351320620580314
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0