element(s):
['Cs']
AFLOW prototype label:
A_tI2_139_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:
['5.404', '1.4448557']
model name:
Morse_Shifted_GirifalcoWeizer_1959LowCutoff_Cs__MO_256406354561_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cs']
representative atom coordinates =  [[0 0 0]]
spacegroup =  139
cell =  [[5.404, 0, 0], [0, 5.404, 0], [0, 0, 7.808]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 09:47:34       -1.423428         0.069121
BFGS:    1 09:47:34       -1.423609         0.067225
BFGS:    2 09:47:34       -1.426795         0.006974
BFGS:    3 09:47:34       -1.426812         0.005989
BFGS:    4 09:47:34       -1.426812         0.006370
BFGS:    5 09:47:34       -1.426816         0.007240
BFGS:    6 09:47:34       -1.426824         0.008137
BFGS:    7 09:47:34       -1.426842         0.008811
BFGS:    8 09:47:34       -1.426872         0.008019
BFGS:    9 09:47:34       -1.426903         0.004785
BFGS:   10 09:47:34       -1.426917         0.001658
BFGS:   11 09:47:34       -1.426919         0.000324
BFGS:   12 09:47:34       -1.426919         0.000036
BFGS:   13 09:47:34       -1.426919         0.000004
BFGS:   14 09:47:34       -1.426919         0.000000
BFGS:   15 09:47:34       -1.426919         0.000000
Minimization converged after 15 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.3718219905328646e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cs', 'Cs']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[5.537868790110649, 1.5284691706987658e-35, -3.7899253749036956e-32], [3.268179404163726e-35, 5.537868790110649, 1.04156074884208e-18], [-9.475755739313489e-33, 1.4942208028455875e-18, 7.83172916966238]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.37182199e-11 -1.37182199e-11 -3.92069021e-12 -2.16012488e-29
 -7.11049806e-45  1.55556992e-60]
energy per atom =  -0.7134595942321307
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Prototype label changed during relaxation: test template prototype is A_tI2_139_a, while relaxed is A_cF4_225_a. Skipping parameter set 0.
No parameter sets in this group successfully added a property instance. Skipping this group.