element(s):
['C']
AFLOW prototype label:
A_cF8_227_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.5727']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0 0 0]]
spacegroup =  227
cell =  [[3.5727, 0, 0], [0, 3.5727, 0], [0, 0, 3.5727]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:25:51     -145.500186       16.3108
BFGS:    1 17:25:51     -147.878834       15.3745
BFGS:    2 17:25:51     -150.102974       14.2468
BFGS:    3 17:25:52     -152.142102       12.9034
BFGS:    4 17:25:52     -153.961828       11.3167
BFGS:    5 17:25:52     -155.523407        9.4560
BFGS:    6 17:25:52     -156.783221        7.2870
BFGS:    7 17:25:52     -157.702112        4.9299
BFGS:    8 17:25:52     -158.229379        2.0315
BFGS:    9 17:25:52     -158.324576        0.2580
BFGS:   10 17:25:52     -158.326035        0.0113
BFGS:   11 17:25:52     -158.326037        0.0001
BFGS:   12 17:25:52     -158.326037        0.0000
BFGS:   13 17:25:52     -158.326037        0.0000
Minimization converged after 13 steps.
Maximum force component: 2.8330829427966285e-30 eV/Angstrom
Maximum stress component: 9.153454199221071e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[3.00222857e-33 3.17312876e-33 1.86310818e-33]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 3.64662028e-33]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]]
cellpar =  Cell([[3.380102863936475, -5.4753282387609715e-34, -3.368354811807737e-33], [2.2127979506657803e-33, 3.380102863936475, 5.816476282261483e-17], [1.690994138126971e-32, 5.816476282261482e-17, 3.3801028639364747]])
forces =  [[ 2.83308294e-30 -2.77753230e-30 -2.11092455e-30]
 [-7.77709043e-31  1.38876615e-30 -5.55506459e-31]
 [-2.22202584e-30  1.44431679e-30 -5.55506459e-31]
 [-7.14747132e-63  2.66643100e-30 -1.77762067e-30]
 [ 1.11101292e-30  8.55282308e-48  4.97026385e-31]
 [ 4.86068152e-31  1.44431679e-30 -1.33321550e-30]
 [ 1.66651938e-30  1.77762067e-30 -2.72284963e-30]
 [-4.44405167e-31 -8.33259689e-31  1.33321550e-30]]
stress =  [-9.15345420e-15 -9.15345420e-15 -9.15345420e-15  4.70423477e-30
 -1.43846521e-32  5.38884996e-48]
energy per atom =  -19.7907546683211
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0