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_1959MedCutoff_Sr__MO_964297938209_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 16:16:59       -6.830891         0.121292
BFGS:    1 16:16:59       -6.831506         0.115322
BFGS:    2 16:16:59       -6.838184         0.022813
BFGS:    3 16:16:59       -6.838423         0.003400
BFGS:    4 16:16:59       -6.838428         0.000031
BFGS:    5 16:16:59       -6.838428         0.000000
BFGS:    6 16:16:59       -6.838428         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 9.820239197771666e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Sr', 'Sr', 'Sr', 'Sr']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [5.62366406e-50 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[6.083469408336782, 9.172888100534358e-33, -4.3258341179138446e-33], [5.13024172970814e-33, 6.083469408336782, 7.535000519809729e-19], [-5.999202482318249e-33, 7.535000519809759e-19, 6.083469408336782]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 9.82023920e-15  9.82023920e-15  9.82023920e-15  6.35670534e-30
 -1.97094594e-62 -1.41863334e-63]
energy per atom =  -1.7096070901179103
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0