element(s):
['Ag', 'O']
AFLOW prototype label:
A2B_cP6_224_b_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.8792']
model name:
Sim_LAMMPS_MEAM_GaoOterodelaRozaAouadi_2013_AgTaO__SM_485325656366_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ag', 'O']
representative atom coordinates =  [[0.25 0.25 0.25]
 [0.   0.   0.  ]]
spacegroup =  224
cell =  [[4.8792, 0, 0], [0, 4.8792, 0], [0, 0, 4.8792]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 17:25:44      -16.584051         0.154718
BFGS:    1 17:25:44      -16.585041         0.143765
BFGS:    2 17:25:44      -16.591159         0.004623
BFGS:    3 17:25:44      -16.591165         0.000132
BFGS:    4 17:25:44      -16.591165         0.000000
BFGS:    5 17:25:44      -16.591165         0.000000
Minimization converged after 5 steps.
Maximum force component: 1.346324162274055e-31 eV/Angstrom
Maximum stress component: 1.4979764297594942e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ag', 'Ag', 'Ag', 'Ag', 'O', 'O']
basis =  [[0.25 0.25 0.25]
 [0.75 0.75 0.25]
 [0.75 0.25 0.75]
 [0.25 0.75 0.75]
 [0.   0.   0.  ]
 [0.5  0.5  0.5 ]]
cellpar =  Cell([[4.854524109961882, 8.869089597563283e-39, 1.3097228914333642e-34], [1.8714279513971092e-33, 4.854524109961882, 1.6022446270293393e-19], [-1.554653993622282e-34, 1.602244627029338e-19, 4.854524109961882]])
forces =  [[ 3.98910863e-32  7.97821726e-32  1.19673259e-31]
 [-4.83698964e-65 -1.19673259e-31  6.98094010e-32]
 [ 3.98910863e-32  3.98910863e-32 -7.97821726e-32]
 [ 4.73706650e-32 -1.34632416e-31 -8.10287690e-32]
 [-9.97277157e-33 -6.58306326e-52 -1.99455431e-32]
 [ 3.98910863e-32  1.31661265e-51  3.98910863e-32]]
stress =  [-1.49797643e-13 -1.49797643e-13 -1.49797643e-13 -2.79505081e-31
  5.23030644e-34  1.51836894e-51]
energy per atom =  -2.7651941869348513
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0