element(s):
['Cu']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.6146']
model name:
Sim_LAMMPS_BOP_ZhouWardFoster_2015_CCu__SM_784926969362_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cu']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[3.6146, 0, 0], [0, 3.6146, 0], [0, 0, 3.6146]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 16:55:27      -33.093189        0.0253
BFGS:    1 16:55:27      -33.093209        0.0120
BFGS:    2 16:55:27      -33.093215        0.0000
BFGS:    3 16:55:27      -33.093215        0.0000
BFGS:    4 16:55:27      -33.093215        0.0000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.0224886980933307e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cu', 'Cu', 'Cu', 'Cu']
basis =  [[0.0000000e+00 0.0000000e+00 0.0000000e+00]
 [4.7315741e-50 5.0000000e-01 5.0000000e-01]
 [5.0000000e-01 0.0000000e+00 5.0000000e-01]
 [5.0000000e-01 5.0000000e-01 0.0000000e+00]]
cellpar =  Cell([[3.615222711434736, -4.8300641428664474e-33, 1.0634532932563342e-33], [2.2730029017855847e-33, 3.615222711434736, -2.6855106364108834e-22], [7.59371202721941e-34, -2.685510636481919e-22, 3.615222711434736]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.02248870e-15 -1.02248870e-15 -1.02248870e-15 -5.20661069e-32
  1.57180656e-34 -4.94550861e-50]
energy per atom =  -8.273303656005094
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0