element(s):
['Bi']
AFLOW prototype label:
A_tI2_139_a
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.1773', '0.86450578']
model name:
MEAM_LAMMPS_ZhouDickelBaskes_2021_Bi__MO_221877348962_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Bi']
representative atom coordinates =  [[0 0 0]]
spacegroup =  139
cell =  [[4.1773, 0, 0], [0, 4.1773, 0], [0, 0, 3.6113]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 17:18:47       -4.507664         0.997682
BFGS:    1 17:18:47       -4.543409         0.706059
BFGS:    2 17:18:47       -4.581724         0.114147
BFGS:    3 17:18:47       -4.582577         0.035120
BFGS:    4 17:18:47       -4.582640         0.049086
BFGS:    5 17:18:47       -4.582779         0.068069
BFGS:    6 17:18:47       -4.583166         0.100664
BFGS:    7 17:18:47       -4.584229         0.153367
BFGS:    8 17:18:47       -4.586411         0.196668
BFGS:    9 17:18:47       -4.588013         0.164770
BFGS:   10 17:18:47       -4.588809         0.095405
BFGS:   11 17:18:47       -4.589786         0.017763
BFGS:   12 17:18:47       -4.589837         0.001139
BFGS:   13 17:18:47       -4.589837         0.000018
BFGS:   14 17:18:47       -4.589837         0.000000
BFGS:   15 17:18:47       -4.589837         0.000000
Minimization converged after 15 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 6.361440200546324e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Bi', 'Bi']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[4.463366115179268, -4.150746955079904e-35, 3.867340019596129e-33], [-8.715608941666219e-35, 4.463366115179268, 4.987000258868096e-17], [-2.0521755768409547e-33, 4.324620273581449e-17, 3.4539648736549253]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 2.85943982e-11  2.85943982e-11  6.36144020e-11 -1.60777118e-26
  1.24928078e-35 -1.88201404e-51]
energy per atom =  -2.2949186077803017
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0