element(s):
['N', 'U']
AFLOW prototype label:
AB_hR2_166_a_b
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:
['3.5114556', '2.6143467']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['N', 'U']
representative atom coordinates =  [[0.  0.  0. ]
 [0.  0.  0.5]]
spacegroup =  166
cell =  [[3.5115, 0, 0], [-1.75575, 3.0410482053891, 0], [0, 0, 9.1802]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 16:06:57      -68.714421       20.6845
BFGS:    1 16:06:57      -71.100750       15.8502
BFGS:    2 16:06:57      -72.789009       11.8947
BFGS:    3 16:06:57      -73.963801        8.6263
BFGS:    4 16:06:57      -74.753709        5.8614
BFGS:    5 16:06:57      -75.240125        3.5493
BFGS:    6 16:06:57      -75.495822        1.6315
BFGS:    7 16:06:57      -75.584921        0.8603
BFGS:    8 16:06:57      -75.598749        0.9378
BFGS:    9 16:06:57      -75.622377        0.7455
BFGS:   10 16:06:57      -75.634246        0.3212
BFGS:   11 16:06:57      -75.636757        0.1045
BFGS:   12 16:06:57      -75.637102        0.0039
BFGS:   13 16:06:57      -75.637105        0.0006
BFGS:   14 16:06:57      -75.637105        0.0000
BFGS:   15 16:06:57      -75.637105        0.0000
BFGS:   16 16:06:57      -75.637105        0.0000
Minimization converged after 16 steps.
Maximum force component: 1.2057549845109104e-30 eV/Angstrom
Maximum stress component: 5.299206689906776e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['N', 'N', 'N', 'U', 'U', 'U']
basis =  [[3.08148791e-33 3.42387546e-33 0.00000000e+00]
 [6.66666667e-01 3.33333333e-01 3.33333333e-01]
 [3.33333333e-01 6.66666667e-01 6.66666667e-01]
 [1.00000000e+00 1.00000000e+00 5.00000000e-01]
 [6.66666667e-01 3.33333333e-01 8.33333333e-01]
 [3.33333333e-01 6.66666667e-01 1.66666667e-01]]
cellpar =  Cell([[3.7439863571773278, 2.0161808053271317e-17, 5.400413013327907e-36], [-1.8719931785886639, 3.2423872967379253, 5.0534704794080634e-36], [2.0349463776336915e-35, 2.7074883985839687e-35, 9.17085617906061]])
forces =  [[-9.10840683e-48 -2.84199175e-31 -6.79619183e-67]
 [ 6.56329882e-31  2.84199175e-31 -2.00959164e-31]
 [-9.10840683e-48 -2.84199175e-31 -6.79619183e-67]
 [-3.28164941e-31 -1.42099588e-31 -1.20575498e-30]
 [-8.20412352e-32 -4.26298763e-31  4.01918328e-31]
 [-4.10206176e-31 -1.42099588e-31 -1.20575498e-30]]
stress =  [-5.29920669e-12 -5.29920669e-12  3.24956172e-12 -8.14491651e-46
 -2.77804465e-46 -1.39073828e-27]
energy per atom =  -12.606184147822846
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Prototype label changed during relaxation: test template prototype is AB_hR2_166_a_b, while relaxed is AB_cF8_225_a_b. Skipping parameter set 0.
No parameter sets in this group successfully added a property instance. Skipping this group.