element(s):
['In', 'N']
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:
['4.6823']
model name:
Sim_LAMMPS_Polymorphic_ZhouJonesChu_2017_GaInN__SM_887684855692_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['In', 'N']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[4.6823, 0, 0], [0, 4.6823, 0], [0, 0, 4.6823]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 11:11:47      -13.623396        13.528777
BFGS:    1 11:11:47      -15.366487         9.998335
BFGS:    2 11:11:47      -16.694779         7.888598
BFGS:    3 11:11:47      -17.773860         6.596256
BFGS:    4 11:11:47      -18.694441         5.726014
BFGS:    5 11:11:47      -19.501894         5.064145
BFGS:    6 11:11:47      -20.218989         4.510033
BFGS:    7 11:11:47      -20.857807         4.011340
BFGS:    8 11:11:47      -21.423904         3.536755
BFGS:    9 11:11:48      -21.918300         3.051110
BFGS:   10 11:11:48      -22.337415         2.529363
BFGS:   11 11:11:48      -22.674486         1.955630
BFGS:   12 11:11:48      -22.921397         1.328284
BFGS:   13 11:11:48      -23.070955         0.661035
BFGS:   14 11:11:48      -23.119026         0.013820
BFGS:   15 11:11:48      -23.119047         0.000067
BFGS:   16 11:11:48      -23.119047         0.000000
BFGS:   17 11:11:48      -23.119047         0.000000
Minimization converged after 17 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.595649380505063e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['In', 'In', 'In', 'In', 'N', 'N', 'N', 'N']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [4.03187983e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 3.02632875e-34]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.41308132e-67 0.00000000e+00]
 [2.68791989e-49 5.00000000e-01 0.00000000e+00]
 [0.00000000e+00 0.00000000e+00 5.00000000e-01]]
cellpar =  Cell([[5.091132139548302, 2.5014787719991387e-32, 4.053692470155151e-34], [-6.0002728255480484e-33, 5.091132139548302, 2.141189932392467e-17], [-3.5562184823834844e-34, 2.1411899323924658e-17, 5.091132139548302]])
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 =  [ 3.59564938e-15  3.59564938e-15  3.59564938e-15  3.47314217e-33
 -2.77401315e-34 -1.25996508e-51]
energy per atom =  -2.88988083311371
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0