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 17:19:19       -6.830891        0.1213
BFGS:    1 17:19:19       -6.831506        0.1153
BFGS:    2 17:19:19       -6.838184        0.0228
BFGS:    3 17:19:19       -6.838423        0.0034
BFGS:    4 17:19:19       -6.838428        0.0000
BFGS:    5 17:19:19       -6.838428        0.0000
BFGS:    6 17:19:19       -6.838428        0.0000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 9.81413325531517e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Sr', 'Sr', 'Sr', 'Sr']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 7.91460356e-36 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 7.91460356e-36]]
cellpar =  Cell([[6.083469408336781, 1.8978295357963004e-32, 2.6914617552762015e-32], [-6.255207671130374e-32, 6.083469408336781, -7.860174606672682e-19], [2.2838792777229417e-32, -7.860174606672716e-19, 6.083469408336781]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [9.81413326e-15 9.81413326e-15 9.81413326e-15 1.78566448e-30
 2.53547537e-62 1.10639954e-62]
energy per atom =  -1.7096070901179106
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0