element(s):
['Sr']
AFLOW prototype label:
A_hP1_191_a
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:
['4.0726', '0.93598684']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Sr']
representative atom coordinates =  [[0 0 0]]
spacegroup =  191
cell =  [[4.0726, 0, 0], [-2.0363, 3.5269750594525, 0], [0, 0, 3.8119]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:34:02       -0.781387         0.916831
BFGS:    1 15:34:02       -0.806628         0.862900
BFGS:    2 15:34:02       -0.874887         0.280946
BFGS:    3 15:34:02       -0.873963         0.406780
BFGS:    4 15:34:02       -0.878905         0.056214
BFGS:    5 15:34:02       -0.879001         0.032642
BFGS:    6 15:34:02       -0.879018         0.014162
BFGS:    7 15:34:02       -0.879023         0.003796
BFGS:    8 15:34:02       -0.879023         0.000598
BFGS:    9 15:34:02       -0.879023         0.000059
BFGS:   10 15:34:02       -0.879023         0.000003
BFGS:   11 15:34:02       -0.879023         0.000000
BFGS:   12 15:34:02       -0.879023         0.000000
Minimization converged after 12 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 8.41821654087982e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Sr']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[3.7668116721605505, 5.871504110555623e-17, -3.490498160169594e-35], [-1.8834058360802752, 3.262154599362777, 9.962467083999332e-35], [1.8979387235217785e-35, 5.757972310646613e-34, 3.6871388466014565]])
forces =  [[0. 0. 0.]]
stress =  [ 8.41821654e-12  8.41821654e-12  2.19755470e-12 -7.07147812e-46
  2.06641277e-46  2.61640287e-27]
energy per atom =  -0.8790231433174543
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0