element(s):
['I', 'Li']
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:
['6.0181']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['I', 'Li']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[6.0181, 0, 0], [0, 6.0181, 0], [0, 0, 6.0181]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:33:59      -33.621640        6.6846
BFGS:    1 14:33:59      -34.635521        6.8330
BFGS:    2 14:33:59      -35.671278        6.9761
BFGS:    3 14:33:59      -36.727997        7.1123
BFGS:    4 14:33:59      -37.804524        7.2399
BFGS:    5 14:33:59      -38.899424        7.3569
BFGS:    6 14:33:59      -40.010942        7.4610
BFGS:    7 14:33:59      -41.137732        7.5628
BFGS:    8 14:33:59      -42.280362        7.6721
BFGS:    9 14:33:59      -43.435296        7.7231
BFGS:   10 14:33:59      -44.596025        7.7487
BFGS:   11 14:33:59      -45.758414        7.7445
BFGS:   12 14:33:59      -46.917632        7.7055
BFGS:   13 14:33:59      -48.068062        7.6263
BFGS:   14 14:33:59      -49.203188        7.5004
BFGS:   15 14:33:59      -50.315477        7.3205
BFGS:   16 14:33:59      -51.396242        7.0786
BFGS:   17 14:33:59      -52.435482        6.7652
BFGS:   18 14:33:59      -53.421709        6.3699
BFGS:   19 14:33:59      -54.341743        5.8805
BFGS:   20 14:33:59      -55.187078        5.3654
BFGS:   21 14:33:59      -55.939841        4.6496
BFGS:   22 14:33:59      -56.574939        3.7934
BFGS:   23 14:33:59      -57.069854        2.7769
BFGS:   24 14:33:59      -57.398880        1.5775
BFGS:   25 14:33:59      -57.532687        0.1695
BFGS:   26 14:33:59      -57.534083        0.0154
BFGS:   27 14:33:59      -57.534094        0.0001
BFGS:   28 14:33:59      -57.534094        0.0000
BFGS:   29 14:33:59      -57.534094        0.0000
Minimization converged after 29 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.455551267093985e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['I', 'I', 'I', 'I', 'Li', 'Li', 'Li', 'Li']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.51838741e-34]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.39439572e-49 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 6.07354964e-34]
 [5.39439572e-49 0.00000000e+00 5.00000000e-01]]
cellpar =  Cell([[5.073619368452194, 3.4819200648155273e-32, -1.2170872174152112e-32], [4.6096049235387824e-33, 5.073619368452194, -8.896187729760126e-18], [2.9937617480348674e-32, -8.896187729760165e-18, 5.073619368452194]])
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 =  [-3.45555127e-14 -3.45555127e-14 -3.45555127e-14  4.86727995e-30
  1.48388564e-34 -1.15957169e-50]
energy per atom =  -7.191761774654881
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0