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_1959MedCutoff_Cs__MO_999639780744_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 20:00:57       -2.966096         0.035246
BFGS:    1 20:00:57       -2.966132         0.034888
BFGS:    2 20:00:58       -2.968018         0.002686
BFGS:    3 20:00:58       -2.968024         0.002944
BFGS:    4 20:00:58       -2.968024         0.002879
BFGS:    5 20:00:58       -2.968024         0.002808
BFGS:    6 20:00:58       -2.968025         0.002422
BFGS:    7 20:00:58       -2.968026         0.001747
BFGS:    8 20:00:59       -2.968028         0.000856
BFGS:    9 20:00:59       -2.968029         0.000446
BFGS:   10 20:00:59       -2.968030         0.000103
BFGS:   11 20:00:59       -2.968030         0.000022
BFGS:   12 20:00:59       -2.968030         0.000001
BFGS:   13 20:01:00       -2.968030         0.000000
BFGS:   14 20:01:00       -2.968030         0.000000
Minimization converged after 14 steps.
Maximum force component: 7.11962199690645e-33 eV/Angstrom
Maximum stress component: 5.247050719626879e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cs', 'Cs', 'Cs', 'Cs']
basis =  [[1.49588561e-32 0.00000000e+00 1.89995083e-35]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [0.00000000e+00 5.00000000e-01 2.50000000e-01]
 [5.00000000e-01 2.93962565e-32 7.50000000e-01]]
cellpar =  Cell([[5.031641354650358, -2.919569147416501e-38, -6.540687261837472e-40], [-2.4852091796074516e-39, 5.031641354650359, 1.4317659076412264e-18], [-4.7309301673593225e-39, 5.251130228189231e-18, 18.48359546424641]])
forces =  [[ 8.51711902e-35 -1.27188977e-33  7.11962200e-33]
 [-1.28165035e-72  1.21132359e-33  2.66985825e-33]
 [-7.26794157e-34 -9.69058875e-34 -7.11962200e-33]
 [ 9.11144007e-73 -1.01133089e-51 -3.55981100e-33]]
stress =  [-5.24705072e-12 -5.24705072e-12 -4.78339115e-12  1.28694070e-27
  1.65666364e-35 -3.99759407e-51]
energy per atom =  -0.7420074029763224
===============================================