element(s):
['Cu']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.8755']
model name:
Sim_LAMMPS_ADP_ApostolMishin_2011_AlCu__SM_667696763561_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cu']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[2.8755, 0, 0], [0, 2.8755, 0], [0, 0, 2.8755]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:51:38       -6.988442        0.0719
BFGS:    1 17:51:38       -6.988641        0.0574
BFGS:    2 17:51:38       -6.988987        0.0007
BFGS:    3 17:51:38       -6.988987        0.0000
BFGS:    4 17:51:38       -6.988987        0.0000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 8.69046985540447e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cu', 'Cu']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.8682711638116216, 5.727831468047288e-33, 1.3736474127886382e-36], [-2.8686379891856877e-33, 2.868271163811622, 1.0108213311291429e-20], [2.2518372145162494e-36, 1.0108213311291433e-20, 2.8682711638116216]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 8.69046986e-11  8.69046986e-11  8.69046986e-11 -2.05372192e-30
 -9.36397107e-35  2.34846349e-53]
energy per atom =  -3.4944666089991943
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0