element(s):
['Xe']
AFLOW prototype label:
A_hP2_194_c
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:
['4.7871', '1.7078398']
model name:
EAM_Dynamo_SmirnovaKuskinStarikov_2013_UMoXe__MO_679329885632_005
==== Building ASE atoms object with: ====
representative atom symbols =  ['Xe']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[4.7871, 0, 0], [-2.39355, 4.1457502104565, 0], [0, 0, 8.1756]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 10:55:22        0.120455         0.043107
BFGS:    1 10:55:22        0.120765         0.041403
BFGS:    2 10:55:22        0.130033         0.018806
BFGS:    3 10:55:22        0.132310         0.018849
BFGS:    4 10:55:22        0.133303         0.018942
BFGS:    5 10:55:22        0.133805         0.019130
BFGS:    6 10:55:22        0.134259         0.019915
BFGS:    7 10:55:22        0.133554         0.022468
BFGS:    8 10:55:22        0.126630         0.016674
BFGS:    9 10:55:22        0.128395         0.020256
BFGS:   10 10:55:23        0.125719         0.018977
BFGS:   11 10:55:23        0.093221         0.032151
BFGS:   12 10:55:23        0.112164         0.007573
BFGS:   13 10:55:23        0.109231         0.003125
BFGS:   14 10:55:23        0.106885         0.002416
BFGS:   15 10:55:23        0.107775         0.000097
BFGS:   16 10:55:23        0.107763         0.000007
BFGS:   17 10:55:23        0.107759         0.000001
BFGS:   18 10:55:23        0.107759         0.000000
Minimization converged after 18 steps.
Maximum force component: 6.992589664808854e-34 eV/Angstrom
Maximum stress component: 5.5237844565429483e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Xe', 'Xe']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[4.841013513281349, 1.10311598872716e-17, -1.5012938723749903e-37], [-2.4205067566406746, 4.192440682565404, 8.52545981700396e-38], [7.980877171711624e-37, 1.0705896825025084e-36, 7.9053419790815775]])
forces =  [[-6.99258966e-34  1.34572451e-34  2.20124852e-71]
 [ 6.99258966e-34 -1.34572451e-34 -2.20124852e-71]]
stress =  [ 7.95747031e-12  7.95747031e-12  5.52378446e-11 -6.00406855e-47
 -1.94692023e-47 -2.43799652e-27]
energy per atom =  0.0538794709974921
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0