element(s):
['Bi']
AFLOW prototype label:
A_hR2_166_c
Parameter names:
['a', 'c/a', 'x1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.5725961', '2.6243649', '0.23493123']
model name:
MEAM_LAMMPS_ZhouDickelBaskes_2021_Bi__MO_221877348962_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Bi']
representative atom coordinates =  [[0.         0.         0.73493123]]
spacegroup =  166
cell =  [[4.5726, 0, 0], [-2.2863, 3.9599877613447, 0], [0, 0, 12.0002]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 15:54:15      -14.412149        0.2822
BFGS:    1 15:54:15      -14.414428        0.2674
BFGS:    2 15:54:15      -14.427401        0.1559
BFGS:    3 15:54:15      -14.428198        0.1253
BFGS:    4 15:54:15      -14.428773        0.0880
BFGS:    5 15:54:15      -14.429112        0.0822
BFGS:    6 15:54:15      -14.432986        0.0622
BFGS:    7 15:54:15      -14.434032        0.0398
BFGS:    8 15:54:15      -14.434287        0.0361
BFGS:    9 15:54:15      -14.435580        0.0063
BFGS:   10 15:54:15      -14.435594        0.0057
BFGS:   11 15:54:15      -14.435598        0.0064
BFGS:   12 15:54:15      -14.435612        0.0073
BFGS:   13 15:54:15      -14.435630        0.0064
BFGS:   14 15:54:15      -14.435645        0.0033
BFGS:   15 15:54:15      -14.435649        0.0007
BFGS:   16 15:54:15      -14.435650        0.0001
BFGS:   17 15:54:15      -14.435650        0.0000
BFGS:   18 15:54:15      -14.435650        0.0000
BFGS:   19 15:54:15      -14.435650        0.0000
BFGS:   20 15:54:15      -14.435650        0.0000
Minimization converged after 20 steps.
Maximum force component: 1.3472439136519304e-10 eV/Angstrom
Maximum stress component: 3.6038582544721513e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Bi', 'Bi', 'Bi', 'Bi', 'Bi', 'Bi']
basis =  [[0.00000000e+00 0.00000000e+00 7.36730999e-01]
 [1.31730741e-17 2.63461482e-17 2.63269001e-01]
 [6.66666667e-01 3.33333333e-01 7.00643322e-02]
 [6.66666667e-01 3.33333333e-01 5.96602334e-01]
 [3.33333333e-01 6.66666667e-01 4.03397666e-01]
 [3.33333333e-01 6.66666667e-01 9.29935668e-01]]
cellpar =  Cell([[4.575167788756887, 7.332024114058639e-18, -3.252243544842223e-17], [-2.287583894378443, 3.96221153163974, -6.514554292103962e-17], [-8.544644334885818e-17, 1.9746616463425448e-16, 11.638407490383626]])
forces =  [[-9.89131160e-28  2.28583891e-27  1.34724391e-10]
 [ 9.89116279e-28 -2.28583755e-27 -1.34724391e-10]
 [-9.89127244e-28  2.28583755e-27  1.34724391e-10]
 [ 9.89110796e-28 -2.28583891e-27 -1.34724391e-10]
 [-9.89117845e-28  2.28583755e-27  1.34724391e-10]
 [ 9.89111579e-28 -2.28583755e-27 -1.34724391e-10]]
stress =  [-1.05087853e-12 -1.05087853e-12 -3.60385825e-12 -4.41092348e-27
 -1.54184880e-27  5.85631426e-28]
energy per atom =  -2.405941678283439
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0