element(s):
['Ga', '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:
['4.2456']
model name:
Sim_LAMMPS_Polymorphic_NordAlbeErhart_2003_GaN__SM_333071728528_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ga', 'N']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[4.2456, 0, 0], [0, 4.2456, 0], [0, 0, 4.2456]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:30:55      -29.755641        0.3953
BFGS:    1 14:30:55      -29.762199        0.3794
BFGS:    2 14:30:55      -29.814961        0.3091
BFGS:    3 14:30:55      -29.839832        0.0259
BFGS:    4 14:30:55      -29.840016        0.0010
BFGS:    5 14:30:55      -29.840016        0.0000
BFGS:    6 14:30:55      -29.840016        0.0000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.1910923444104864e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ga', 'Ga', 'Ga', 'Ga', 'N', 'N', 'N', 'N']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.78982032e-34]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 0.00000000e+00]
 [0.00000000e+00 0.00000000e+00 5.00000000e-01]]
cellpar =  Cell([[4.304186123444337, 2.0000780004953234e-32, -1.3607597849547075e-32], [2.856715762008853e-33, 4.304186123444337, 9.61024959355597e-18], [2.198465973134914e-32, 9.610249593555932e-18, 4.304186123444337]])
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 =  [ 2.19109234e-10  2.19109234e-10  2.19109234e-10 -4.60522750e-28
  1.22044483e-57 -9.94709863e-60]
energy per atom =  -3.730001974020331
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0