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:
EDIP_LAMMPS_Marks_2000_C__MO_374144505645_000
==== 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 16:25:34      -58.773249         0.001669
BFGS:    1 16:25:34      -58.773249         0.001535
BFGS:    2 16:25:34      -58.773250         0.000000
BFGS:    3 16:25:34      -58.773250         0.000000
Minimization converged after 3 steps.
Maximum force component: 4.330136579843618e-31 eV/Angstrom
Maximum stress component: 2.291305403050197e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[0.00000000e+00 1.73333695e-33 2.35985763e-34]
 [3.46667390e-33 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 5.61193902e-34]
 [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([[3.5725669322905866, -4.312708300270828e-34, 8.239403756202241e-36], [3.593922853552622e-35, 3.5725669322905866, 8.9728787816977e-25], [-7.922187305077958e-36, 8.972878781697698e-25, 3.5725669322905866]])
forces =  [[ 1.66049729e-31  6.23833236e-32  2.34854865e-31]
 [-1.27060152e-31 -2.49533294e-31 -6.26729197e-56]
 [ 1.46784291e-32  3.37603869e-31  7.33921454e-32]
 [-7.33921454e-32  1.90819578e-31  2.05498007e-31]
 [ 1.17427433e-31  3.22925440e-31  2.75220545e-32]
 [-5.87137163e-32 -4.33013658e-31 -1.46784291e-31]
 [ 4.10996014e-31  5.87137163e-32  3.66960727e-33]
 [ 7.33921454e-33  3.66960727e-32 -7.33921454e-32]]
stress =  [ 2.29130540e-12  2.29130540e-12  2.29130540e-12  1.21774759e-30
  5.52258462e-64 -1.74945297e-63]
energy per atom =  -7.3466562560648265
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0