element(s):
['C']
AFLOW prototype label:
A_cP1_221_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['1.774']
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 =  221
cell =  [[1.774, 0, 0], [0, 1.774, 0], [0, 0, 1.774]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 17:28:48       -0.737226        16.953185
BFGS:    1 17:28:48       -2.634772         8.932511
BFGS:    2 17:28:48       -3.562293         3.831420
BFGS:    3 17:28:48       -3.844455         1.334898
BFGS:    4 17:28:48       -3.894118         0.349306
BFGS:    5 17:28:48       -3.898324         0.048655
BFGS:    6 17:28:48       -3.898412         0.002208
BFGS:    7 17:28:48       -3.898412         0.000015
BFGS:    8 17:28:48       -3.898412         0.000000
Minimization converged after 8 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 6.123885049621457e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[2.0684118720140203, -4.849170568994197e-33, -6.776261894530887e-33], [-1.1342950716264647e-32, 2.0684118720140203, 2.4753824517017646e-18], [4.2582005859031036e-33, 2.4753824517017542e-18, 2.0684118720140203]])
forces =  [[0. 0. 0.]]
stress =  [-6.12388505e-10 -6.12388505e-10 -6.12388505e-10  2.88346735e-26
  6.46220662e-36 -2.97784694e-52]
energy per atom =  -3.89841219855981
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0