element(s):
['Na']
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:
['4.1144']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Na']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[4.1144, 0, 0], [0, 4.1144, 0], [0, 0, 4.1144]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 18:01:26       -8.653774        5.9083
BFGS:    1 18:01:26       -9.545658        5.9277
BFGS:    2 18:01:26      -10.415875        5.5589
BFGS:    3 18:01:26      -11.172030        4.3572
BFGS:    4 18:01:26      -11.659351        1.8696
BFGS:    5 18:01:26      -11.701040        1.3714
BFGS:    6 18:01:26      -11.728350        0.1784
BFGS:    7 18:01:26      -11.728881        0.0144
BFGS:    8 18:01:26      -11.728884        0.0002
BFGS:    9 18:01:26      -11.728884        0.0000
BFGS:   10 18:01:26      -11.728884        0.0000
Minimization converged after 10 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 6.34759870343027e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Na', 'Na']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.6542743376782942, 1.0330467725383648e-32, -9.881481155292797e-34], [6.759566018839752e-33, 3.6542743376782942, -1.4837138437467883e-17], [2.2999423325766418e-33, -1.4837138437467883e-17, 3.6542743376782942]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 6.34759870e-14  6.34759870e-14  6.34759870e-14 -1.75775786e-30
  2.30758747e-34 -9.06628516e-51]
energy per atom =  -5.864442093622465
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0