element(s):
['C', 'Pt']
AFLOW prototype label:
AB_hP2_187_a_d
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:
['3.0042', '0.95496305']
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.        ]
 [0.33333333 0.66666667 0.5       ]]
spacegroup =  187
cell =  [[3.0042, 0, 0], [-1.5021, 2.6017135180492, 0], [0, 0, 2.8689]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 15:32:36      -10.904506        2.8067
BFGS:    1 15:32:36      -11.026395        0.9580
BFGS:    2 15:32:36      -11.037470        0.2893
BFGS:    3 15:32:36      -11.041285        0.2750
BFGS:    4 15:32:36      -11.046070        0.0621
BFGS:    5 15:32:36      -11.046291        0.0065
BFGS:    6 15:32:36      -11.046293        0.0017
BFGS:    7 15:32:36      -11.046293        0.0003
BFGS:    8 15:32:36      -11.046293        0.0000
BFGS:    9 15:32:36      -11.046293        0.0000
BFGS:   10 15:32:36      -11.046293        0.0000
Minimization converged after 10 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 6.747263401080967e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'Pt']
basis =  [[0.         0.         0.        ]
 [0.33333333 0.66666667 0.5       ]]
cellpar =  Cell([[3.0187399917513247, 1.3326981486336192e-17, 7.533231660308537e-38], [-1.5093699958756623, 2.6143055202766736, 4.077669040156657e-37], [-4.644380332465305e-36, 1.8920714318985654e-35, 2.9982864794374673]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 3.57679655e-10  3.57679655e-10  6.74726340e-10 -5.24167076e-34
 -9.07884007e-34  1.08032899e-25]
energy per atom =  -5.523146674700502
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0