element(s):
['B', 'Hf']
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:
['4.838']
model name:
Tersoff_LAMMPS_DawLawsonBauschlicher_2011_HfB__MO_328263916986_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['B', 'Hf']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[4.838, 0, 0], [0, 4.838, 0], [0, 0, 4.838]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 19:15:12      -47.996304         0.745768
BFGS:    1 19:15:12      -48.019584         0.710562
BFGS:    2 19:15:12      -48.111890         0.510297
BFGS:    3 19:15:12      -48.169579         0.248215
BFGS:    4 19:15:12      -48.183634         0.060256
BFGS:    5 19:15:12      -48.184400         0.004684
BFGS:    6 19:15:12      -48.184405         0.000076
BFGS:    7 19:15:12      -48.184405         0.000000
BFGS:    8 19:15:12      -48.184405         0.000000
Minimization converged after 8 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.5452996493332298e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['B', 'B', 'B', 'B', 'Hf', 'Hf', 'Hf', 'Hf']
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 1.62264593e-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]
 [7.20599550e-50 0.00000000e+00 5.00000000e-01]]
cellpar =  Cell([[4.747628317069958, 1.335837257083358e-32, 4.2816739600299336e-33], [1.2516014073407097e-32, 4.747628317069958, -7.006624806138281e-18], [-3.945351558753638e-33, -7.006624806138278e-18, 4.747628317069958]])
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 =  [ 1.54529965e-13  1.54529965e-13  1.54529965e-13 -6.76932179e-31
 -3.40729868e-63  3.08362106e-62]
energy per atom =  -6.0230505894600075
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0