element(s):
['U']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.7679']
model name:
EAM_Dynamo_SmirnovaKuskinStarikov_2013_UMoXe__MO_679329885632_005
==== Building ASE atoms object with: ====
representative atom symbols =  ['U']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[3.7679, 0, 0], [0, 3.7679, 0], [0, 0, 3.7679]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 18:11:48       -7.552596        2.2090
BFGS:    1 18:11:48       -7.811846        3.4848
BFGS:    2 18:11:48       -8.238676        1.4619
BFGS:    3 18:11:48       -8.294045        0.1224
BFGS:    4 18:11:48       -8.294780        0.0525
BFGS:    5 18:11:48       -8.294938        0.0025
BFGS:    6 18:11:48       -8.294938        0.0001
BFGS:    7 18:11:48       -8.294938        0.0000
BFGS:    8 18:11:48       -8.294938        0.0000
Minimization converged after 8 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.260430708843313e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['U', 'U']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.55520394371892, 7.920744866808603e-34, -8.561687062204525e-33], [-3.7404354198709018e-34, 3.55520394371892, 1.177962414638701e-18], [1.2750062385029645e-32, 1.1779624146386767e-18, 3.55520394371892]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 4.26043071e-14  4.26043071e-14  4.26043071e-14  2.06538485e-29
 -2.03165604e-35 -7.21789060e-51]
energy per atom =  -4.1474691542942095
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0