element(s):
['Bi']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.97']
model name:
MEAM_LAMMPS_ZhouDickelBaskes_2021_Bi__MO_221877348962_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Bi']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[3.97, 0, 0], [0, 3.97, 0], [0, 0, 3.97]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:59:29       -4.488128         1.073067
BFGS:    1 15:59:29       -4.529856         0.746656
BFGS:    2 15:59:29       -4.573466         0.105698
BFGS:    3 15:59:29       -4.574490         0.012913
BFGS:    4 15:59:29       -4.574505         0.000271
BFGS:    5 15:59:29       -4.574506         0.000001
BFGS:    6 15:59:29       -4.574506         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.2048055183610414e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Bi', 'Bi']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[4.083144985830929, 7.396257987533424e-34, 2.190371139427455e-33], [1.2569437006067967e-32, 4.083144985830929, -1.6584660095976844e-18], [-1.1421431799518183e-32, -1.6584660095976746e-18, 4.083144985830929]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.20480552e-12 -1.20480552e-12 -1.20480552e-12  2.05622359e-29
  8.18139680e-47 -3.28979748e-61]
energy per atom =  -2.287252752049631
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0