element(s):
['I', 'Na']
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:
['6.4903']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['I', 'Na']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[6.4903, 0, 0], [0, 6.4903, 0], [0, 0, 6.4903]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:33:59      -35.296545        5.8346
BFGS:    1 14:33:59      -36.172653        5.8435
BFGS:    2 14:33:59      -37.048542        5.8312
BFGS:    3 14:33:59      -37.920788        5.7944
BFGS:    4 14:33:59      -38.785450        5.7294
BFGS:    5 14:33:59      -39.640441        5.6506
BFGS:    6 14:33:59      -40.479831        5.5363
BFGS:    7 14:33:59      -41.297749        5.3617
BFGS:    8 14:33:59      -42.085952        5.1391
BFGS:    9 14:33:59      -42.836747        4.8618
BFGS:   10 14:33:59      -43.541380        4.5223
BFGS:   11 14:33:59      -44.189899        4.1121
BFGS:   12 14:33:59      -44.773577        3.6495
BFGS:   13 14:33:59      -45.278710        3.0695
BFGS:   14 14:33:59      -45.689297        2.3867
BFGS:   15 14:33:59      -45.989195        1.5897
BFGS:   16 14:33:59      -46.159560        0.6584
BFGS:   17 14:33:59      -46.190442        0.0890
BFGS:   18 14:33:59      -46.190977        0.0041
BFGS:   19 14:33:59      -46.190978        0.0000
BFGS:   20 14:33:59      -46.190978        0.0000
Minimization converged after 20 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.4338793524165805e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['I', 'I', 'I', 'I', 'Na', 'Na', 'Na', 'Na']
basis =  [[0.  0.  0. ]
 [0.  0.5 0.5]
 [0.5 0.  0.5]
 [0.5 0.5 0. ]
 [0.5 0.5 0.5]
 [0.5 0.  0. ]
 [0.  0.5 0. ]
 [0.  0.  0.5]]
cellpar =  Cell([[5.815853351946769, 3.7944565320520065e-32, 1.4995122148721355e-32], [2.7681709382501675e-32, 5.815853351946769, 1.0332245973303502e-17], [-1.9797946174371275e-32, 1.0332245973303536e-17, 5.815853351946769]])
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 =  [-2.43387935e-10 -2.43387935e-10 -2.43387935e-10 -4.14932333e-28
 -2.27757970e-34  2.66211003e-52]
energy per atom =  -5.773872280365696
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0