element(s):
['Pt']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.949']
model name:
Tersoff_LAMMPS_AlbeNordlundAverback_2002_PtC__MO_500121566391_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['Pt']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[3.949, 0, 0], [0, 3.949, 0], [0, 0, 3.949]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:38:17      -23.049162         0.612389
BFGS:    1 15:38:18      -23.063140         0.451958
BFGS:    2 15:38:18      -23.079078         0.027814
BFGS:    3 15:38:18      -23.079135         0.001155
BFGS:    4 15:38:18      -23.079135         0.000003
BFGS:    5 15:38:18      -23.079135         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.837478741477463e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Pt', 'Pt', 'Pt', 'Pt']
basis =  [[0.0000000e+00 0.0000000e+00 0.0000000e+00]
 [0.0000000e+00 5.0000000e-01 5.0000000e-01]
 [5.0000000e-01 4.8011376e-38 5.0000000e-01]
 [5.0000000e-01 5.0000000e-01 4.8011376e-38]]
cellpar =  Cell([[3.9173860819076474, -1.625645323325796e-32, -1.2513548531970575e-32], [-1.769877182476659e-32, 3.9173860819076474, 2.6182212730419228e-21], [1.1646026688115813e-34, 2.6182212730315638e-21, 3.9173860819076474]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.83747874e-11 -1.83747874e-11 -1.83747874e-11 -3.02834632e-27
  1.00400927e-34  1.19328031e-50]
energy per atom =  -5.769783708854287
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0