element(s):
['As', 'Ga']
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:
['5.7352']
model name:
Tersoff_LAMMPS_AlbeNordlundNord_2002_GaAs__MO_799020228312_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['As', 'Ga']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.25 0.25 0.25]]
spacegroup =  216
cell =  [[5.7352, 0, 0], [0, 5.7352, 0], [0, 0, 5.7352]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 13:02:53      -26.759332         0.425752
BFGS:    1 13:02:54      -26.766911         0.404888
BFGS:    2 13:02:54      -26.814421         0.226535
BFGS:    3 13:02:54      -26.834240         0.035562
BFGS:    4 13:02:54      -26.834718         0.001446
BFGS:    5 13:02:54      -26.834718         0.000009
BFGS:    6 13:02:54      -26.834718         0.000000
Minimization converged after 6 steps.
Maximum force component: 2.0321970015767407e-31 eV/Angstrom
Maximum stress component: 9.193726928558989e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['As', 'As', 'As', 'As', 'Ga', 'Ga', 'Ga', 'Ga']
basis =  [[5.12805970e-34 1.02716264e-33 5.13581319e-34]
 [1.02730531e-33 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 6.81415382e-34 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 9.53981535e-34]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]]
cellpar =  Cell([[5.65273398600579, 1.1812983006484764e-33, 1.0528329805532491e-32], [-4.225555014998994e-34, 5.65273398600579, -1.0019863874887535e-17], [3.1322961581101373e-34, -1.0019863874887524e-17, 5.65273398600579]])
forces =  [[ 8.68066446e-67 -1.16125543e-32  2.05840596e-50]
 [-1.16125543e-32 -2.57300745e-51  1.45156929e-33]
 [-1.16125543e-32 -1.16125543e-32  2.90313857e-33]
 [-3.21737758e-67  1.02920298e-50 -5.80627715e-33]
 [ 7.25784643e-34 -6.38690486e-32 -1.62575760e-31]
 [-5.80627715e-33  1.45156929e-32  7.54816029e-32]
 [-2.32251086e-32 -8.41910186e-32 -1.45156929e-33]
 [-6.24174793e-32 -2.32251086e-32  2.03219700e-31]]
stress =  [9.19372693e-11 9.19372693e-11 9.19372693e-11 4.28889643e-26
 3.21456430e-35 3.73513890e-51]
energy per atom =  -3.3543398115732828
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0