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:
MEAM_LAMMPS_MooreBeelerDeo_2015_UZr__MO_453094726678_001
==== 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 16:14:33       -9.725049         2.607187
BFGS:    1 16:14:33      -10.000960         2.314924
BFGS:    2 16:14:33      -10.308139         1.741410
BFGS:    3 16:14:33      -10.509487         0.889040
BFGS:    4 16:14:33      -10.555752         0.346570
BFGS:    5 16:14:33      -10.561935         0.046083
BFGS:    6 16:14:33      -10.562054         0.002010
BFGS:    7 16:14:33      -10.562054         0.000012
BFGS:    8 16:14:33      -10.562054         0.000000
Minimization converged after 8 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.482363993407068e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['U', 'U']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.438318336359922, -3.350102817231913e-33, -3.9406553417074287e-35], [-4.229493875479006e-33, 3.4383183363599223, -2.591827726939839e-18], [6.140971626516937e-34, -2.591827726939839e-18, 3.4383183363599223]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.48236399e-10  1.48236399e-10  1.48236399e-10  5.48370890e-28
 -1.08606811e-35 -2.13696352e-52]
energy per atom =  -5.281027204487214
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0