element(s):
['Sr']
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:
['4.7514']
model name:
Morse_Shifted_GirifalcoWeizer_1959LowCutoff_Sr__MO_801083489225_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['Sr']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[4.7514, 0, 0], [0, 4.7514, 0], [0, 0, 4.7514]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:22:59       -3.162684         0.340544
BFGS:    1 16:22:59       -3.167376         0.302579
BFGS:    2 16:22:59       -3.186257         0.030910
BFGS:    3 16:22:59       -3.186482         0.003255
BFGS:    4 16:22:59       -3.186485         0.000041
BFGS:    5 16:22:59       -3.186485         0.000000
BFGS:    6 16:22:59       -3.186485         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.7004238051701588e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Sr', 'Sr']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[4.866798856906875, -1.6804712853349467e-33, -6.621665116608224e-33], [-5.4537105726972834e-33, 4.866798856906875, 1.291858598224995e-20], [1.883040325435638e-33, 1.2918585982242889e-20, 4.866798856906875]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.70042381e-14 -1.70042381e-14 -1.70042381e-14 -1.64447269e-30
 -2.16831524e-35  4.08781409e-52]
energy per atom =  -1.5932424749417322
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0