element(s):
['C', 'Pt']
AFLOW prototype label:
AB_cF8_225_a_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.454']
model name:
Tersoff_LAMMPS_AlbeNordlundAverback_2002_PtC__MO_500121566391_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'Pt']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[4.454, 0, 0], [0, 4.454, 0], [0, 0, 4.454]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:30:06      -44.390800         2.046774
BFGS:    1 16:30:06      -44.536504         1.266080
BFGS:    2 16:30:07      -44.620852         0.096606
BFGS:    3 16:30:07      -44.621324         0.002984
BFGS:    4 16:30:07      -44.621324         0.000005
BFGS:    5 16:30:07      -44.621324         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.8801606209918076e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'Pt', 'Pt', 'Pt', 'Pt']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 0.00000000e+00]
 [0.00000000e+00 8.72816996e-35 5.00000000e-01]]
cellpar =  Cell([[4.413135752709437, -3.350424071679172e-32, 1.1260485660610383e-34], [-1.0012390719800925e-32, 4.413135752709437, 6.444265783965028e-18], [-1.8610307383253735e-33, 6.444265783965028e-18, 4.413135752709437]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.88016062e-11 -2.88016062e-11 -2.88016062e-11 -1.72802744e-28
  2.10962193e-34  3.53806792e-52]
energy per atom =  -5.577665539564528
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0