element(s):
['Au']
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:
['4.134']
model name:
MEAM_LAMMPS_LeeShimBaskes_2003_Au__MO_774911580446_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Au']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[4.134, 0, 0], [0, 4.134, 0], [0, 0, 4.134]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 16:49:14      -15.648669        0.7748
BFGS:    1 16:49:14      -15.672225        0.6431
BFGS:    2 16:49:14      -15.719913        0.0292
BFGS:    3 16:49:14      -15.719999        0.0028
BFGS:    4 16:49:14      -15.720000        0.0000
BFGS:    5 16:49:14      -15.720000        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.306382020442258e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Au', 'Au', 'Au', 'Au']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 2.30888897e-38 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[4.072935045894285, 2.0177745506515724e-33, -4.953925555575594e-34], [1.639139754100786e-33, 4.072935045894285, -8.826986490059699e-22], [-1.7636969097706943e-35, -8.826986490070415e-22, 4.072935045894285]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.30638202e-10 -2.30638202e-10 -2.30638202e-10  2.20655949e-26
  3.86994028e-36 -2.43477930e-52]
energy per atom =  -3.9300000001224586
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0