element(s):
['In', 'P']
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:
['5.9396']
model name:
Sim_LAMMPS_Vashishta_BranicioRinoGan_2009_InP__SM_090647175366_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['In', 'P']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.25 0.25 0.25]]
spacegroup =  216
cell =  [[5.9396, 0, 0], [0, 5.9396, 0], [0, 0, 5.9396]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 19:10:30      -27.805065         0.384819
BFGS:    1 19:10:30      -27.811244         0.364543
BFGS:    2 19:10:30      -27.851586         0.170364
BFGS:    3 19:10:30      -27.861950         0.015348
BFGS:    4 19:10:30      -27.862030         0.000573
BFGS:    5 19:10:30      -27.862030         0.000002
BFGS:    6 19:10:30      -27.862030         0.000000
Minimization converged after 6 steps.
Maximum force component: 8.07728249137125e-31 eV/Angstrom
Maximum stress component: 8.577034743029845e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['In', 'In', 'In', 'In', 'P', 'P', 'P', 'P']
basis =  [[0.   0.   0.  ]
 [0.   0.5  0.5 ]
 [0.5  0.   0.5 ]
 [0.5  0.5  0.  ]
 [0.25 0.25 0.25]
 [0.75 0.75 0.25]
 [0.75 0.25 0.75]
 [0.25 0.75 0.75]]
cellpar =  Cell([[5.868420966247013, 4.157009398764718e-33, 1.8884630392997807e-32], [-5.601668140992395e-33, 5.868420966247013, -3.791679104466896e-20], [9.962304920612905e-35, -3.791679104466656e-20, 5.868420966247013]])
forces =  [[ 3.61669365e-32  2.41112910e-32  1.80834683e-32]
 [ 1.20556455e-32 -1.80834683e-32  6.02782275e-33]
 [-3.01391138e-33  1.13021677e-32  1.20556455e-32]
 [ 1.20556455e-32 -1.20556455e-32 -1.80834683e-32]
 [-1.56723392e-31 -1.02472987e-31 -8.07728249e-31]
 [ 1.11514721e-31 -2.59196378e-31  1.48435135e-31]
 [-2.57689423e-31 -2.45364280e-51  3.79752834e-31]
 [ 6.02782275e-32 -2.59949856e-31 -1.20556455e-32]]
stress =  [-8.57703474e-12 -8.57703474e-12 -8.57703474e-12  1.88185608e-27
 -2.98261154e-34 -1.15154288e-51]
energy per atom =  -3.482753807882368
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0