element(s):
['C']
AFLOW prototype label:
A_cF8_227_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.5727']
model name:
Sim_LAMMPS_MEAM_KimJungLee_2009_FeTiC__SM_531038274471_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0 0 0]]
spacegroup =  227
cell =  [[3.5727, 0, 0], [0, 3.5727, 0], [0, 0, 3.5727]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:25:16      -58.948466         0.210270
BFGS:    1 16:25:16      -58.950284         0.193201
BFGS:    2 16:25:16      -58.959996         0.004003
BFGS:    3 16:25:16      -58.960000         0.000074
BFGS:    4 16:25:16      -58.960000         0.000000
BFGS:    5 16:25:16      -58.960000         0.000000
Minimization converged after 5 steps.
Maximum force component: 1.8630712675352709e-31 eV/Angstrom
Maximum stress component: 3.1639903525746015e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[6.41976648e-35 0.00000000e+00 0.00000000e+00]
 [1.92592994e-34 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 6.41976327e-34 5.00000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]]
cellpar =  Cell([[3.556477606488929, -1.805088121788377e-35, -3.130411811592966e-35], [5.776293265010924e-34, 3.556477606488929, -5.593857317794882e-23], [1.1563889936062068e-34, -5.593857317824666e-23, 3.556477606488929]])
forces =  [[-4.38369710e-32 -1.46123237e-32 -1.49196574e-32]
 [ 2.19184855e-32  1.86307127e-31 -7.21483481e-32]
 [ 5.84492947e-32 -9.13270229e-33  5.11431328e-32]
 [-4.38369710e-32 -8.76739420e-32  1.24204751e-31]
 [-2.92246473e-32 -3.56175389e-32  1.82654046e-33]
 [ 1.46123237e-32 -6.39289160e-32  2.55715664e-32]
 [ 1.18725130e-31 -8.95004825e-32 -6.21023756e-32]
 [ 3.65308092e-32  8.76739420e-32 -3.65308092e-33]]
stress =  [-3.16399035e-14 -3.16399035e-14 -3.16399035e-14  2.23162781e-31
 -6.88314842e-65  7.11050683e-64]
energy per atom =  -7.37000000251069
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0