element(s):
['B', 'Zr']
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:
['4.9147']
model name:
Tersoff_LAMMPS_DawLawsonBauschlicher_2011pot2_ZrB__MO_728716510644_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['B', 'Zr']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[4.9147, 0, 0], [0, 4.9147, 0], [0, 0, 4.9147]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 19:15:12      -44.956134         0.909586
BFGS:    1 19:15:12      -44.991301         0.894337
BFGS:    2 19:15:12      -45.119845         0.813215
BFGS:    3 19:15:12      -45.233110         0.689026
BFGS:    4 19:15:12      -45.323958         0.513001
BFGS:    5 19:15:12      -45.384066         0.278163
BFGS:    6 19:15:12      -45.404224         0.020259
BFGS:    7 19:15:12      -45.404316         0.002073
BFGS:    8 19:15:12      -45.404317         0.000013
BFGS:    9 19:15:12      -45.404317         0.000000
Minimization converged after 9 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 5.905991570595348e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['B', 'B', 'B', 'B', 'Zr', 'Zr', 'Zr', 'Zr']
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 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 7.19478859e-50 7.19478859e-50]
 [1.43895772e-49 5.00000000e-01 0.00000000e+00]
 [0.00000000e+00 0.00000000e+00 5.00000000e-01]]
cellpar =  Cell([[4.755023422709649, 3.725094988968653e-33, 5.8549349753623115e-33], [6.020998542269162e-33, 4.755023422709649, -1.2695042694986746e-17], [-2.2560650342936978e-33, -1.2695042694986741e-17, 4.755023422709649]])
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 =  [-5.90599157e-10 -5.90599157e-10 -5.90599157e-10 -2.26620317e-26
  1.02215418e-34  7.06490137e-51]
energy per atom =  -5.675539665960091
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0