element(s):
['Cs']
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:
['7.7355']
model name:
Morse_Shifted_GirifalcoWeizer_1959HighCutoff_Cs__MO_187111446479_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cs']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[7.7355, 0, 0], [0, 7.7355, 0], [0, 0, 7.7355]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 16:52:44       -3.230247        0.0370
BFGS:    1 16:52:44       -3.230305        0.0366
BFGS:    2 16:52:44       -3.232956        0.0008
BFGS:    3 16:52:44       -3.232957        0.0001
BFGS:    4 16:52:44       -3.232957        0.0000
BFGS:    5 16:52:44       -3.232957        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.6078150935794416e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cs', 'Cs', 'Cs', 'Cs']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 2.01553654e-34 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 4.03107307e-34]]
cellpar =  Cell([[7.6443365211204855, 2.520264234738452e-33, -2.094207480102257e-33], [-1.932526757193964e-34, 7.6443365211204855, 2.04294021607154e-17], [-7.953514560272177e-34, 2.0429402160715396e-17, 7.6443365211204855]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-3.60781509e-14 -3.60781509e-14 -3.60781509e-14 -2.52303587e-30
 -7.55287572e-37 -4.59508725e-53]
energy per atom =  -0.8082391729825308
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0