element(s):
['Sr']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.0197']
model name:
Morse_Shifted_GirifalcoWeizer_1959HighCutoff_Sr__MO_497591319122_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['Sr']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[6.0197, 0, 0], [0, 6.0197, 0], [0, 0, 6.0197]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:18:07       -6.917029        0.1076
BFGS:    1 17:18:07       -6.917514        0.1024
BFGS:    2 17:18:07       -6.922400        0.0060
BFGS:    3 17:18:07       -6.922417        0.0001
BFGS:    4 17:18:07       -6.922417        0.0000
BFGS:    5 17:18:07       -6.922417        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.9521856631065746e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Sr', 'Sr', 'Sr', 'Sr']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [5.63600110e-50 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 7.93196639e-36]]
cellpar =  Cell([[6.070152881459094, -2.7075170353684542e-33, 3.6298583352259374e-33], [3.7439035169193535e-33, 6.070152881459094, -7.7363847911912e-19], [4.167528645546741e-33, -7.736384791191103e-19, 6.070152881459094]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.95218566e-13 -1.95218566e-13 -1.95218566e-13  1.27618177e-29
  7.95600549e-62  2.03412619e-62]
energy per atom =  -1.7306041751559433
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0