element(s):
['Sr']
AFLOW prototype label:
A_tI4_141_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:
['7.4144', '0.53583567']
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 =  141
cell =  [[7.4144, 0, 0], [0, 7.4144, 0], [0, 0, 3.9729]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:27:50       -5.968781         0.435464
BFGS:    1 16:27:50       -5.975850         0.412436
BFGS:    2 16:27:50       -6.020590         0.250572
BFGS:    3 16:27:50       -6.044094         0.096393
BFGS:    4 16:27:50       -6.048994         0.011041
BFGS:    5 16:27:50       -6.049028         0.006154
BFGS:    6 16:27:50       -6.049029         0.006374
BFGS:    7 16:27:50       -6.049034         0.005972
BFGS:    8 16:27:50       -6.049038         0.004013
BFGS:    9 16:27:50       -6.049040         0.001178
BFGS:   10 16:27:50       -6.049041         0.000270
BFGS:   11 16:27:50       -6.049041         0.000027
BFGS:   12 16:27:50       -6.049041         0.000003
BFGS:   13 16:27:50       -6.049041         0.000000
BFGS:   14 16:27:50       -6.049041         0.000000
Minimization converged after 14 steps.
Maximum force component: 1.1802934589969087e-32 eV/Angstrom
Maximum stress component: 1.9062787381871303e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Sr', 'Sr', 'Sr', 'Sr']
basis =  [[4.96622879e-33 0.00000000e+00 1.30070481e-32]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [1.08993390e-32 5.00000000e-01 2.50000000e-01]
 [5.00000000e-01 1.86545537e-32 7.50000000e-01]]
cellpar =  Cell([[7.660542524123568, 2.2595229442096113e-37, -3.181850437040498e-39], [-2.944178603112369e-37, 7.660542524123568, 5.949102760719929e-18], [1.2183061213307674e-37, 3.1967808733820568e-18, 4.112020244104283]])
forces =  [[ 4.30158816e-70 -1.18029346e-32 -7.91946292e-34]
 [-7.33241325e-73 -1.92399250e-53 -2.47483216e-35]
 [ 1.18029346e-32  3.48134632e-70 -4.90241683e-72]
 [ 5.90146729e-33 -1.18029346e-32 -1.18791944e-33]]
stress =  [-1.90627874e-11 -1.90627874e-11 -8.35159406e-12 -2.84492470e-28
  4.93495285e-49  1.55369367e-64]
energy per atom =  -1.5122602313293219
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0