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 17:23:34       -2.657894         0.069635
BFGS:    1 17:23:34       -2.658024         0.068735
BFGS:    2 17:23:34       -2.663664         0.034417
BFGS:    3 17:23:34       -2.665522         0.007042
BFGS:    4 17:23:34       -2.665560         0.001776
BFGS:    5 17:23:34       -2.665561         0.001426
BFGS:    6 17:23:34       -2.665561         0.001444
BFGS:    7 17:23:34       -2.665563         0.001425
BFGS:    8 17:23:34       -2.665564         0.000965
BFGS:    9 17:23:34       -2.665564         0.000255
BFGS:   10 17:23:34       -2.665564         0.000052
BFGS:   11 17:23:34       -2.665564         0.000004
BFGS:   12 17:23:34       -2.665564         0.000000
BFGS:   13 17:23:34       -2.665564         0.000000
BFGS:   14 17:23:34       -2.665564         0.000000
Minimization converged after 14 steps.
Maximum force component: 3.655829927710587e-33 eV/Angstrom
Maximum stress component: 9.86488943470563e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cs', 'Cs', 'Cs', 'Cs']
basis =  [[0.00000000e+00 4.97355735e-33 2.31111593e-33]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [0.00000000e+00 5.00000000e-01 2.50000000e-01]
 [5.00000000e-01 1.42529895e-32 7.50000000e-01]]
cellpar =  Cell([[5.188785822048273, -3.0185460859123765e-38, 6.567417391735994e-40], [2.194082061750216e-38, 5.188785822048275, 4.850195230818034e-17], [-4.422012560400395e-38, 1.7616010365971545e-16, 18.982154248989286]])
forces =  [[ 2.49830950e-34 -2.89647757e-33  3.65582993e-33]
 [ 4.99661899e-34  4.99661899e-34  1.07104392e-33]
 [ 1.10081762e-33  9.99323799e-34  1.82791496e-33]
 [-9.99323799e-34 -4.99661899e-34  2.74187245e-33]]
stress =  [ 9.86488943e-13  9.86488943e-13  4.85391778e-13  3.99824481e-28
 -1.28349593e-50 -1.19603628e-65]
energy per atom =  -0.6663911184685779
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0