element(s):
['Na']
AFLOW prototype label:
A_hP4_194_ac
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.463', '1.4525207']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Na', 'Na']
representative atom coordinates =  [[0.         0.         0.        ]
 [0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[4.463, 0, 0], [-2.2315, 3.8650713770899, 0], [0, 0, 6.4826]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 14:27:42      -15.247128         6.361595
BFGS:    1 14:27:42      -15.945716         4.138970
BFGS:    2 14:27:42      -16.353210         2.407427
BFGS:    3 14:27:42      -16.550279         1.074945
BFGS:    4 14:27:42      -16.601425         0.423354
BFGS:    5 14:27:42      -16.610203         0.600173
BFGS:    6 14:27:42      -16.623040         0.727561
BFGS:    7 14:27:42      -16.644203         0.714220
BFGS:    8 14:27:42      -16.658125         0.416198
BFGS:    9 14:27:42      -16.665561         0.164109
BFGS:   10 14:27:42      -16.667310         0.009201
BFGS:   11 14:27:42      -16.667316         0.000146
BFGS:   12 14:27:42      -16.667316         0.000002
BFGS:   13 14:27:42      -16.667316         0.000000
BFGS:   14 14:27:42      -16.667316         0.000000
Minimization converged after 14 steps.
Maximum force component: 4.91276583581406e-31 eV/Angstrom
Maximum stress component: 7.492557042633086e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Na', 'Na', 'Na', 'Na']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [4.64463843e-52 6.48234091e-52 5.00000000e-01]
 [3.33333333e-01 6.66666667e-01 2.50000000e-01]
 [6.66666667e-01 3.33333333e-01 7.50000000e-01]]
cellpar =  Cell([[4.761000529070037, 4.3321635371776083e-19, -1.1199924681911268e-36], [-2.3805002645350184, 4.1231474056058035, -5.464055710011763e-36], [3.105998297720794e-36, 3.746633400598807e-35, 6.446344491274488]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [-3.61883818e-31  4.91276584e-31 -2.64857768e-32]
 [ 7.82451497e-32  7.11973844e-51 -1.84066307e-68]]
stress =  [ 7.49255704e-13  7.49255704e-13  2.70309261e-13 -9.84428132e-49
  7.33266348e-49 -1.10528662e-29]
energy per atom =  -4.16682902046867
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0