element(s):
['Cs']
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:
['5.0985', '3.6231244']
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 =  141
cell =  [[5.0985, 0, 0], [0, 5.0985, 0], [0, 0, 18.4725]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 15:22:06       -2.657894        0.0696
BFGS:    1 15:22:06       -2.658024        0.0687
BFGS:    2 15:22:06       -2.663664        0.0344
BFGS:    3 15:22:06       -2.665522        0.0070
BFGS:    4 15:22:07       -2.665560        0.0018
BFGS:    5 15:22:07       -2.665561        0.0014
BFGS:    6 15:22:07       -2.665561        0.0014
BFGS:    7 15:22:07       -2.665563        0.0014
BFGS:    8 15:22:07       -2.665564        0.0010
BFGS:    9 15:22:07       -2.665564        0.0003
BFGS:   10 15:22:07       -2.665564        0.0001
BFGS:   11 15:22:07       -2.665564        0.0000
BFGS:   12 15:22:07       -2.665564        0.0000
BFGS:   13 15:22:07       -2.665564        0.0000
BFGS:   14 15:22:07       -2.665564        0.0000
Minimization converged after 14 steps.
Maximum force component: 7.311659855421171e-33 eV/Angstrom
Maximum stress component: 9.864848513480492e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cs', 'Cs', 'Cs', 'Cs']
basis =  [[1.28940858e-32 1.86034647e-32 2.58074609e-32]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [0.00000000e+00 5.00000000e-01 2.50000000e-01]
 [5.00000000e-01 1.30652404e-32 7.50000000e-01]]
cellpar =  Cell([[5.188785822048274, 1.0769586671949807e-38, -4.962438384405248e-39], [2.2511500411532504e-39, 5.188785822048273, -1.550052390032097e-18], [3.9807157616025516e-39, -5.66686285986202e-18, 18.98215424898928]])
forces =  [[ 1.12685744e-72 -9.36866062e-34  7.31165986e-33]
 [ 4.07287046e-73 -5.79805234e-52  1.94215965e-33]
 [-1.24915475e-34  3.99729520e-33 -1.19411693e-51]
 [-4.99661899e-34  1.99864760e-33 -5.97058463e-52]]
stress =  [9.86484851e-13 9.86484851e-13 4.85380047e-13 3.36598394e-28
 1.15537679e-51 4.72683479e-67]
energy per atom =  -0.666391118468578
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0