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 15:10:26        0.120455        0.0431
BFGS:    1 15:10:26        0.120765        0.0414
BFGS:    2 15:10:26        0.130033        0.0188
BFGS:    3 15:10:26        0.132310        0.0188
BFGS:    4 15:10:26        0.133303        0.0189
BFGS:    5 15:10:26        0.133805        0.0191
BFGS:    6 15:10:26        0.134259        0.0199
BFGS:    7 15:10:26        0.133554        0.0225
BFGS:    8 15:10:26        0.126630        0.0167
BFGS:    9 15:10:26        0.128395        0.0203
BFGS:   10 15:10:26        0.125719        0.0190
BFGS:   11 15:10:26        0.093221        0.0322
BFGS:   12 15:10:26        0.112164        0.0076
BFGS:   13 15:10:26        0.109231        0.0031
BFGS:   14 15:10:26        0.106885        0.0024
BFGS:   15 15:10:26        0.107775        0.0001
BFGS:   16 15:10:26        0.107763        0.0000
BFGS:   17 15:10:26        0.107759        0.0000
BFGS:   18 15:10:26        0.107759        0.0000
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