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 17:36:22      -98.230416        4.0276
BFGS:    1 17:36:22      -99.418437        0.7026
BFGS:    2 17:36:22      -99.469080        0.1390
BFGS:    3 17:36:22      -99.472023        0.1448
BFGS:    4 17:36:22      -99.473159        0.1389
BFGS:    5 17:36:22      -99.480042        0.1153
BFGS:    6 17:36:22      -99.482815        0.0830
BFGS:    7 17:36:22      -99.483627        0.0212
BFGS:    8 17:36:22      -99.483674        0.0022
BFGS:    9 17:36:22      -99.483675        0.0001
BFGS:   10 17:36:22      -99.483675        0.0000
BFGS:   11 17:36:23      -99.483675        0.0000
BFGS:   12 17:36:23      -99.483675        0.0000
Minimization converged after 12 steps.
Maximum force component: 1.0876545668772023e-09 eV/Angstrom
Maximum stress component: 1.2401090660135835e-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([[4.495840929483471, -2.7897982281808823e-37, 0.0], [-3.67943037166552e-36, 4.495840929483471, 0.0], [0.0, 0.0, 4.495840929483471]])
forces =  [[ 1.08765457e-09  1.08765457e-09  1.08765457e-09]
 [-1.08765457e-09 -1.08765457e-09  1.08765457e-09]
 [-1.08765457e-09  1.08765457e-09 -1.08765457e-09]
 [ 1.08765457e-09 -1.08765457e-09 -1.08765457e-09]
 [ 1.08765457e-09  1.08765457e-09  1.08765457e-09]
 [-1.08765457e-09 -1.08765457e-09  1.08765457e-09]
 [-1.08765457e-09  1.08765457e-09 -1.08765457e-09]
 [ 1.08765457e-09 -1.08765457e-09 -1.08765457e-09]
 [-1.08765457e-09 -1.08765457e-09 -1.08765457e-09]
 [ 1.08765457e-09  1.08765457e-09 -1.08765457e-09]
 [ 1.08765457e-09 -1.08765457e-09  1.08765457e-09]
 [-1.08765457e-09  1.08765457e-09  1.08765457e-09]
 [-1.08765457e-09 -1.08765457e-09 -1.08765457e-09]
 [ 1.08765457e-09  1.08765457e-09 -1.08765457e-09]
 [ 1.08765457e-09 -1.08765457e-09  1.08765457e-09]
 [-1.08765457e-09  1.08765457e-09  1.08765457e-09]]
stress =  [-1.24010907e-10 -1.24010907e-10 -1.24010907e-10  0.00000000e+00
  0.00000000e+00 -3.82569012e-63]
energy per atom =  -6.217729703151508
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0