element(s):
['Xe']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.8524']
model name:
EAM_Dynamo_SmirnovaKuskinStarikov_2013_UMoXe__MO_679329885632_005
==== Building ASE atoms object with: ====
representative atom symbols =  ['Xe']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[6.8524, 0, 0], [0, 6.8524, 0], [0, 0, 6.8524]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:24:04        0.220213        0.0034
BFGS:    1 17:24:04        0.220150        0.0033
BFGS:    2 17:24:04        0.215334        0.0001
BFGS:    3 17:24:04        0.215525        0.0000
BFGS:    4 17:24:04        0.215518        0.0000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.0589573594099899e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Xe', 'Xe', 'Xe', 'Xe']
basis =  [[0.0000000e+00 0.0000000e+00 0.0000000e+00]
 [0.0000000e+00 5.0000000e-01 5.0000000e-01]
 [5.0000000e-01 1.3735967e-38 5.0000000e-01]
 [5.0000000e-01 5.0000000e-01 0.0000000e+00]]
cellpar =  Cell([[6.846226982194947, -7.201595454281492e-33, -1.1299262034793912e-34], [-3.598920859412208e-32, 6.846226982194947, 1.2062611868793532e-21], [-1.2295265144813285e-33, 1.2062611868793534e-21, 6.846226982194947]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.05895736e-10  1.05895736e-10  1.05895736e-10  2.30383811e-28
  2.37201155e-60 -8.59127202e-59]
energy per atom =  0.05387947319571614
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0