element(s):
['C']
AFLOW prototype label:
A_hP4_194_bc
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:
['2.4677', '3.3769097']
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.         0.25      ]
 [0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[2.4677, 0, 0], [-1.23385, 2.1370908889189, 0], [0, 0, 8.3332]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:28:47      -29.492329         0.342485
BFGS:    1 15:28:47      -29.495654         0.272359
BFGS:    2 15:28:47      -29.502304         0.145239
BFGS:    3 15:28:47      -29.502643         0.145198
BFGS:    4 15:28:47      -29.509933         0.143320
BFGS:    5 15:28:47      -29.517044         0.139614
BFGS:    6 15:28:47      -29.523906         0.133785
BFGS:    7 15:28:47      -29.530413         0.125475
BFGS:    8 15:28:47      -29.536433         0.114269
BFGS:    9 15:28:47      -29.541812         0.099695
BFGS:   10 15:28:47      -29.546367         0.081223
BFGS:   11 15:28:47      -29.549889         0.058257
BFGS:   12 15:28:47      -29.552137         0.030138
BFGS:   13 15:28:47      -29.552833         0.004008
BFGS:   14 15:28:47      -29.552843         0.002060
BFGS:   15 15:28:47      -29.552844         0.000924
BFGS:   16 15:28:47      -29.552844         0.000018
BFGS:   17 15:28:47      -29.552844         0.000001
BFGS:   18 15:28:47      -29.552844         0.000000
Minimization converged after 18 steps.
Maximum force component: 5.2459606546237025e-31 eV/Angstrom
Maximum stress component: 9.26505218684296e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C']
basis =  [[0.00000000e+00 8.51376273e-37 2.50000000e-01]
 [0.00000000e+00 2.47820478e-36 7.50000000e-01]
 [3.33333333e-01 6.66666667e-01 2.50000000e-01]
 [6.66666667e-01 3.33333333e-01 7.50000000e-01]]
cellpar =  Cell([[2.4554012945011983, 6.150706594866008e-19, -8.145407241062e-34], [-1.2277006472505991, 2.1264398975232335, -1.6290806548883294e-33], [-2.5075130750866033e-33, -7.240729235349785e-33, 7.269024803590064]])
forces =  [[ 4.03535435e-32 -6.98943876e-32  7.46647069e-33]
 [-4.03535435e-32  6.98943876e-32  3.73323534e-33]
 [ 5.24596065e-31 -3.49471938e-31  1.60639703e-64]
 [ 1.21060630e-31  3.49471938e-31 -3.74826147e-64]]
stress =  [ 9.26505219e-10  9.26505219e-10 -1.65421325e-10  9.96784227e-35
  1.72648109e-34  1.84570953e-27]
energy per atom =  -7.388210937173367
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0