element(s):
['Sr']
AFLOW prototype label:
A_hP1_191_a
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:
['4.0726', '0.93598684']
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 =  191
cell =  [[4.0726, 0, 0], [-2.0363, 3.5269750594525, 0], [0, 0, 3.8119]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:33:51       -1.538608         0.445158
BFGS:    1 15:33:51       -1.543605         0.351376
BFGS:    2 15:33:51       -1.553283         0.038294
BFGS:    3 15:33:51       -1.553451         0.011113
BFGS:    4 15:33:51       -1.553457         0.008194
BFGS:    5 15:33:51       -1.553459         0.006475
BFGS:    6 15:33:51       -1.553461         0.001614
BFGS:    7 15:33:51       -1.553461         0.000200
BFGS:    8 15:33:51       -1.553461         0.000019
BFGS:    9 15:33:51       -1.553461         0.000001
BFGS:   10 15:33:51       -1.553461         0.000000
BFGS:   11 15:33:51       -1.553461         0.000000
Minimization converged after 11 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.3421772411467427e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Sr']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[4.177349746833386, -2.817607628628381e-17, 4.2636959684933746e-39], [-2.088674873416693, 3.617691001250207, 1.1070562361167362e-36], [-1.433444095428456e-36, -6.405551946175942e-36, 3.9436115635349904]])
forces =  [[0. 0. 0.]]
stress =  [-7.42911475e-13 -7.42911475e-13 -1.34217724e-11  2.68340156e-47
  8.03172796e-48 -9.79525112e-31]
energy per atom =  -1.5534608336282059
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0