element(s):
['C']
AFLOW prototype label:
A_cI8_214_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.1243']
model name:
Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0.125 0.125 0.125]]
spacegroup =  214
cell =  [[4.1243, 0, 0], [0, 4.1243, 0], [0, 0, 4.1243]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:33:52      -59.454243         0.987014
BFGS:    1 16:33:52      -59.494675         0.924421
BFGS:    2 16:33:52      -59.616098         0.691706
BFGS:    3 16:33:52      -59.701308         0.441408
BFGS:    4 16:33:52      -59.747586         0.172419
BFGS:    5 16:33:52      -59.755443         0.010372
BFGS:    6 16:33:52      -59.755470         0.000224
BFGS:    7 16:33:53      -59.755471         0.000000
BFGS:    8 16:33:53      -59.755471         0.000000
Minimization converged after 8 steps.
Maximum force component: 1.0912176683923062e-30 eV/Angstrom
Maximum stress component: 9.218791137029722e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[0.125 0.125 0.125]
 [0.375 0.875 0.625]
 [0.875 0.625 0.375]
 [0.625 0.375 0.875]
 [0.875 0.375 0.125]
 [0.625 0.625 0.625]
 [0.375 0.125 0.875]
 [0.125 0.875 0.375]]
cellpar =  Cell([[4.024095221286272, 3.5032487124749743e-34, 2.1952358325035086e-33], [-6.872874797319846e-34, 4.024095221286272, 1.5966165030034234e-20], [-7.383179087775674e-34, 1.596616503003793e-20, 4.024095221286272]])
forces =  [[-6.61344041e-32 -2.64537617e-31 -5.62142435e-31]
 [-1.09121767e-30  3.30672021e-31  5.95209637e-31]
 [ 1.05815047e-30 -4.99108081e-31  1.32268808e-31]
 [ 2.64537617e-31  1.32268808e-31  3.63739223e-31]
 [ 3.96806425e-31  1.57438542e-51  3.96806425e-31]
 [ 1.17146287e-64 -3.30672021e-31 -3.30672021e-31]
 [ 5.78676036e-32  3.96806425e-31  2.64537617e-31]
 [ 2.39737215e-31 -7.10944845e-31  5.29075233e-31]]
stress =  [-9.21879114e-13 -9.21879114e-13 -9.21879114e-13 -4.09130661e-28
 -3.73570343e-62 -1.44647366e-62]
energy per atom =  -7.46943381335263
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0