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_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_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 16:05:14       -6.871291         0.046801
BFGS:    1 16:05:14       -6.871375         0.036859
BFGS:    2 16:05:14       -6.871512         0.000302
BFGS:    3 16:05:14       -6.871512         0.000002
BFGS:    4 16:05:14       -6.871512         0.000000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 8.414930663511927e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cu', 'Cu']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.871003887549676, -2.0939048047671104e-33, -1.6785009512750468e-35], [-6.603594341082385e-34, 2.8710038875496764, 1.357793478778046e-22], [3.5033042213057084e-36, 1.3577934787777398e-22, 2.871003887549676]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 8.41493066e-12  8.41493066e-12  8.41493066e-12 -1.87017621e-29
  2.49230764e-34 -3.88654439e-52]
energy per atom =  -3.4357558003210147
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0