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:
EAM_Dynamo_NicholAckland_2016v2_Cs__MO_144828415103_000
==== 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 17:23:46       -2.851641         0.310998
BFGS:    1 17:23:46       -2.855262         0.309349
BFGS:    2 17:23:46       -2.893860         0.270007
BFGS:    3 17:23:46       -2.925090         0.194216
BFGS:    4 17:23:46       -2.944697         0.092237
BFGS:    5 17:23:46       -2.949535         0.020467
BFGS:    6 17:23:46       -2.949720         0.005229
BFGS:    7 17:23:46       -2.949721         0.004651
BFGS:    8 17:23:46       -2.949722         0.003878
BFGS:    9 17:23:46       -2.949724         0.002899
BFGS:   10 17:23:46       -2.949728         0.002807
BFGS:   11 17:23:46       -2.949731         0.001659
BFGS:   12 17:23:46       -2.949732         0.000561
BFGS:   13 17:23:46       -2.949733         0.000120
BFGS:   14 17:23:46       -2.949733         0.000008
BFGS:   15 17:23:46       -2.949733         0.000000
BFGS:   16 17:23:46       -2.949733         0.000000
BFGS:   17 17:23:46       -2.949733         0.000000
Minimization converged after 17 steps.
Maximum force component: 1.3667670265476702e-32 eV/Angstrom
Maximum stress component: 1.6745989956810553e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cs', 'Cs', 'Cs', 'Cs']
basis =  [[0.00000000e+00 6.88127487e-33 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [2.75373079e-33 5.00000000e-01 2.50000000e-01]
 [5.00000000e-01 0.00000000e+00 7.50000000e-01]]
cellpar =  Cell([[4.853615978945012, 2.5236686846373937e-37, 9.367720673997535e-39], [-4.804803622479505e-37, 4.853615978945012, 3.293254493442111e-17], [-2.6578106131102677e-37, 1.2055157561617543e-16, 17.741650345731138]])
forces =  [[ 7.30290965e-35  1.46058193e-35  1.36676703e-32]
 [ 5.84232772e-35  8.76349158e-35  1.14253181e-32]
 [-4.38174579e-35  5.84232772e-35 -6.83383513e-33]
 [-8.76349158e-35 -1.46058193e-34 -1.19592115e-32]]
stress =  [ 3.90147074e-13  3.90147074e-13  1.67459900e-12 -3.28520645e-28
  2.23656260e-36 -4.96616659e-52]
energy per atom =  -0.7374331396422996
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0