element(s):
['Na']
AFLOW prototype label:
A_hP2_194_c
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:
['3.669', '1.6326519']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Na']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[3.669, 0, 0], [-1.8345, 3.1774472064851, 0], [0, 0, 5.9902]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 15:00:48       -8.715671        6.1685
BFGS:    1 15:00:48       -9.655012        6.3125
BFGS:    2 15:00:48      -10.589464        6.0694
BFGS:    3 15:00:48      -11.441456        5.1485
BFGS:    4 15:00:48      -12.072813        3.0384
BFGS:    5 15:00:48      -12.254937        1.0468
BFGS:    6 15:00:48      -12.268886        0.2522
BFGS:    7 15:00:48      -12.269858        0.0161
BFGS:    8 15:00:48      -12.269861        0.0009
BFGS:    9 15:00:48      -12.269861        0.0002
BFGS:   10 15:00:48      -12.269861        0.0000
BFGS:   11 15:00:48      -12.269861        0.0000
BFGS:   12 15:00:48      -12.269861        0.0000
Minimization converged after 12 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.9868141781458134e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Na', 'Na']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[3.228905618479378, -6.755863771152041e-17, -5.632695392272965e-36], [-1.614452809239689, 2.796314292025446, -3.29626998450172e-35], [1.188248209187976e-34, -3.850467334869418e-34, 5.2728859770951955]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.98681418e-11  1.98681418e-11  1.56171479e-11 -8.35961155e-34
 -4.82642398e-34 -2.33219741e-27]
energy per atom =  -6.134930613075392
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0