element(s):
['C', 'Pt']
AFLOW prototype label:
AB_cF8_216_a_c
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.7065']
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.  ]
 [0.25 0.25 0.25]]
spacegroup =  216
cell =  [[4.7065, 0, 0], [0, 4.7065, 0], [0, 0, 4.7065]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 19:05:46      -37.980969         2.085658
BFGS:    1 19:05:46      -38.156464         1.842532
BFGS:    2 19:05:46      -38.403406         1.454031
BFGS:    3 19:05:46      -38.593845         1.088955
BFGS:    4 19:05:46      -38.731208         0.746183
BFGS:    5 19:05:46      -38.818761         0.424647
BFGS:    6 19:05:46      -38.859613         0.123321
BFGS:    7 19:05:46      -38.863553         0.005600
BFGS:    8 19:05:46      -38.863562         0.000079
BFGS:    9 19:05:46      -38.863562         0.000000
BFGS:   10 19:05:46      -38.863562         0.000000
Minimization converged after 10 steps.
Maximum force component: 1.8560611083221146e-31 eV/Angstrom
Maximum stress component: 3.385837450805492e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'Pt', 'Pt', 'Pt', 'Pt']
basis =  [[0.00000000e+00 1.28395330e-34 0.00000000e+00]
 [1.28005408e-34 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 7.88713271e-35 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 3.15485308e-34]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]]
cellpar =  Cell([[4.883726484116344, -5.6085465806263996e-33, -1.9946565121886157e-34], [7.77466656970513e-34, 4.883726484116344, -5.7873050348563475e-18], [-3.7793935055634124e-34, -5.787305034856347e-18, 4.883726484116344]])
forces =  [[-5.01638137e-33  5.01638137e-33 -5.95695288e-33]
 [ 2.00655255e-32 -2.30435580e-65 -8.19534657e-67]
 [ 2.00655255e-32 -2.30435580e-65 -8.19534657e-67]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 2.23603716e-65  1.40458678e-31 -1.66446098e-49]
 [ 2.13953252e-65  1.85606111e-31  1.05344009e-31]
 [ 1.40458678e-31  1.80589729e-31 -1.00327627e-31]
 [ 3.48716348e-65  1.60524204e-31 -1.20393153e-31]]
stress =  [-3.38583745e-14 -3.38583745e-14 -3.38583745e-14  1.31892919e-30
  4.27642354e-50 -4.29674440e-64]
energy per atom =  -4.857945204787999
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0