element(s):
['Co']
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:
['2.9317', '0.99628202']
model name:
Sim_LAMMPS_Table_GrogerVitekDlouhy_2020_CoCrFeMnNi__SM_786004631953_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Co']
representative atom coordinates =  [[0 0 0]]
spacegroup =  139
cell =  [[2.9317, 0, 0], [0, 2.9317, 0], [0, 0, 2.9208]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:07:50       -3.333039        1.1802
BFGS:    1 17:07:50       -3.388437        1.0260
BFGS:    2 17:07:50       -3.493071        0.3199
BFGS:    3 17:07:50       -3.498586        0.1680
BFGS:    4 17:07:50       -3.500238        0.0234
BFGS:    5 17:07:51       -3.500253        0.0105
BFGS:    6 17:07:51       -3.500255        0.0090
BFGS:    7 17:07:51       -3.500289        0.0243
BFGS:    8 17:07:51       -3.500512        0.1157
BFGS:    9 17:07:52       -3.500329        0.3322
BFGS:   10 17:07:52       -3.500787        0.1815
BFGS:   11 17:07:52       -3.501027        0.2057
BFGS:   12 17:07:52       -3.506805        0.2433
BFGS:   13 17:07:53       -3.510817        0.2521
BFGS:   14 17:07:53       -3.512746        0.1736
BFGS:   15 17:07:53       -3.514632        0.0143
BFGS:   16 17:07:53       -3.514638        0.0044
BFGS:   17 17:07:53       -3.514640        0.0007
BFGS:   18 17:07:54       -3.514641        0.0001
BFGS:   19 17:07:54       -3.514641        0.0000
BFGS:   20 17:07:54       -3.514641        0.0000
BFGS:   21 17:07:54       -3.514641        0.0000
Minimization converged after 21 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.7825744710229014e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Co']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.9282043937183504, 7.952446822605748e-34, -6.836639502145765e-33], [5.977371805209319e-34, 2.9282043937183504, 9.1149449389769e-18], [4.805061776892991e-33, 7.211645331200523e-18, 2.5862953480690773]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.78257447e-11 -2.78257447e-11 -1.41658919e-11  5.40287627e-27
  3.11658905e-44 -5.26743752e-61]
energy per atom =  -1.7573202682284665
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0