element(s):
['C']
AFLOW prototype label:
A_cI16_206_c
Parameter names:
['a', 'x1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.4773', '0.15607601']
model name:
Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0.15607601 0.15607601 0.15607601]]
spacegroup =  206
cell =  [[4.4773, 0, 0], [0, 4.4773, 0], [0, 0, 4.4773]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:36:06      -98.230416         4.027555
BFGS:    1 16:36:07      -99.418437         0.702581
BFGS:    2 16:36:07      -99.469080         0.138986
BFGS:    3 16:36:08      -99.472023         0.144794
BFGS:    4 16:36:08      -99.473159         0.138913
BFGS:    5 16:36:09      -99.480042         0.115275
BFGS:    6 16:36:10      -99.482815         0.082956
BFGS:    7 16:36:10      -99.483627         0.021195
BFGS:    8 16:36:11      -99.483674         0.002209
BFGS:    9 16:36:11      -99.483675         0.000110
BFGS:   10 16:36:12      -99.483675         0.000009
BFGS:   11 16:36:12      -99.483675         0.000000
BFGS:   12 16:36:13      -99.483675         0.000000
Minimization converged after 12 steps.
Maximum force component: 1.087678749390302e-09 eV/Angstrom
Maximum stress component: 1.2400726075229516e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[0.15092608 0.15092608 0.15092608]
 [0.34907392 0.84907392 0.65092608]
 [0.84907392 0.65092608 0.34907392]
 [0.65092608 0.34907392 0.84907392]
 [0.65092608 0.65092608 0.65092608]
 [0.84907392 0.34907392 0.15092608]
 [0.34907392 0.15092608 0.84907392]
 [0.15092608 0.84907392 0.34907392]
 [0.84907392 0.84907392 0.84907392]
 [0.65092608 0.15092608 0.34907392]
 [0.15092608 0.34907392 0.65092608]
 [0.34907392 0.65092608 0.15092608]
 [0.34907392 0.34907392 0.34907392]
 [0.15092608 0.65092608 0.84907392]
 [0.65092608 0.84907392 0.15092608]
 [0.84907392 0.15092608 0.65092608]]
cellpar =  Cell([[4.495840929483473, 5.64342885486901e-38, 0.0], [-1.036828063187928e-36, 4.495840929483473, 0.0], [0.0, 0.0, 4.495840929483473]])
forces =  [[ 1.08767875e-09  1.08767875e-09  1.08767875e-09]
 [-1.08767875e-09 -1.08767875e-09  1.08767875e-09]
 [-1.08767875e-09  1.08767875e-09 -1.08767875e-09]
 [ 1.08767875e-09 -1.08767875e-09 -1.08767875e-09]
 [ 1.08767875e-09  1.08767875e-09  1.08767875e-09]
 [-1.08767875e-09 -1.08767875e-09  1.08767875e-09]
 [-1.08767875e-09  1.08767875e-09 -1.08767875e-09]
 [ 1.08767875e-09 -1.08767875e-09 -1.08767875e-09]
 [-1.08767875e-09 -1.08767875e-09 -1.08767875e-09]
 [ 1.08767875e-09  1.08767875e-09 -1.08767875e-09]
 [ 1.08767875e-09 -1.08767875e-09  1.08767875e-09]
 [-1.08767875e-09  1.08767875e-09  1.08767875e-09]
 [-1.08767875e-09 -1.08767875e-09 -1.08767875e-09]
 [ 1.08767875e-09  1.08767875e-09 -1.08767875e-09]
 [ 1.08767875e-09 -1.08767875e-09  1.08767875e-09]
 [-1.08767875e-09  1.08767875e-09  1.08767875e-09]]
stress =  [-1.24007261e-10 -1.24007261e-10 -1.24007261e-10  0.00000000e+00
  0.00000000e+00 -1.62617514e-33]
energy per atom =  -6.217729703151509
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0