element(s):
['Sr']
AFLOW prototype label:
A_hP2_194_c
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:
['4.2616', '1.6451333']
model name:
Morse_Shifted_GirifalcoWeizer_1959LowCutoff_Sr__MO_801083489225_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['Sr']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[4.2616, 0, 0], [-2.1308, 3.6906538607678, 0], [0, 0, 7.0109]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 15:10:11       -3.194227        0.2168
BFGS:    1 15:10:11       -3.195903        0.1948
BFGS:    2 15:10:11       -3.203063        0.0177
BFGS:    3 15:10:11       -3.203103        0.0104
BFGS:    4 15:10:11       -3.203105        0.0109
BFGS:    5 15:10:11       -3.203114        0.0097
BFGS:    6 15:10:11       -3.203121        0.0059
BFGS:    7 15:10:11       -3.203124        0.0015
BFGS:    8 15:10:11       -3.203125        0.0004
BFGS:    9 15:10:11       -3.203125        0.0000
BFGS:   10 15:10:11       -3.203125        0.0000
BFGS:   11 15:10:11       -3.203125        0.0000
BFGS:   12 15:10:11       -3.203125        0.0000
Minimization converged after 12 steps.
Maximum force component: 2.912374896999485e-32 eV/Angstrom
Maximum stress component: 1.636335847109806e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Sr', 'Sr']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[4.3326409989801835, -3.0439955160158844e-18, 8.167232027944748e-38], [-2.1663204994900918, 3.7521771705948286, 2.977782110657305e-37], [4.4451894988671933e-38, -9.608882401415598e-37, 7.0883976696403685]])
forces =  [[-5.56290869e-33  1.92704810e-33 -2.91237490e-32]
 [ 5.56290869e-33 -1.92704810e-33  2.91237490e-32]]
stress =  [-1.63633585e-11 -1.63633585e-11 -3.71966245e-12  2.31717617e-34
  6.68911142e-35 -1.79469800e-27]
energy per atom =  -1.6015624482948483
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0