element(s):
['Te']
AFLOW prototype label:
A_hR1_166_a
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:
['4.5333378', '1.216872']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Te']
representative atom coordinates =  [[0 0 0]]
spacegroup =  166
cell =  [[4.5333, 0, 0], [-2.26665, 3.925952962976, 0], [0, 0, 5.5165]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:45:35      -22.262500        12.390660
BFGS:    1 16:45:35      -24.182796        13.270753
BFGS:    2 16:45:35      -26.236611        14.178196
BFGS:    3 16:45:35      -28.418632        14.936858
BFGS:    4 16:45:35      -30.704525        15.529356
BFGS:    5 16:45:35      -33.065075        15.917671
BFGS:    6 16:45:35      -35.443488        15.835282
BFGS:    7 16:45:35      -37.752332        15.156280
BFGS:    8 16:45:35      -39.872895        13.554524
BFGS:    9 16:45:35      -41.635341        10.777397
BFGS:   10 16:45:35      -42.819624         6.426176
BFGS:   11 16:45:35      -43.237173         0.740287
BFGS:   12 16:45:35      -43.249080         0.807857
BFGS:   13 16:45:35      -43.319045         2.134987
BFGS:   14 16:45:35      -43.479433         2.766694
BFGS:   15 16:45:35      -43.756561         4.886597
BFGS:   16 16:45:35      -44.073919         5.478752
BFGS:   17 16:45:35      -44.539999         7.785243
BFGS:   18 16:45:35      -45.070903         9.427786
BFGS:   19 16:45:35      -45.667270        10.695872
BFGS:   20 16:45:35      -46.375538        12.423493
BFGS:   21 16:45:35      -47.194529        14.462521
BFGS:   22 16:45:35      -48.125665        16.623096
BFGS:   23 16:45:35      -49.174782        19.004930
BFGS:   24 16:45:35      -50.349652        21.555198
BFGS:   25 16:45:35      -51.658388        24.161278
BFGS:   26 16:45:35      -53.095831        26.856166
BFGS:   27 16:45:35      -54.663618        29.289401
BFGS:   28 16:45:35      -56.324675        30.983570
BFGS:   29 16:45:35      -58.040832        31.532363
BFGS:   30 16:45:35      -59.798558        29.977409
BFGS:   31 16:45:35      -61.452164        24.756284
BFGS:   32 16:45:35      -62.416773         9.542842
BFGS:   33 16:45:35      -62.790277         6.052419
BFGS:   34 16:45:36      -62.805079         6.084512
BFGS:   35 16:45:36      -62.833156         0.366591
BFGS:   36 16:45:36      -62.833268         0.022421
BFGS:   37 16:45:36      -62.833268         0.000090
BFGS:   38 16:45:36      -62.833268         0.000000
BFGS:   39 16:45:36      -62.833268         0.000000
Minimization converged after 39 steps.
Maximum force component: 6.522380996251689e-31 eV/Angstrom
Maximum stress component: 3.8764120390896186e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Te', 'Te', 'Te']
basis =  [[0.00000000e+00 0.00000000e+00 1.23210484e-32]
 [6.66666667e-01 3.33333333e-01 3.33333333e-01]
 [3.33333333e-01 6.66666667e-01 6.66666667e-01]]
cellpar =  Cell([[4.296230880651099, 7.688445041486084e-17, -1.5935884754763832e-16], [-2.1481154403255496, 3.720645083167043, -3.2698953452691543e-16], [-3.644473163958883e-16, 2.702624462683227e-16, 2.6308933686887013]])
forces =  [[-4.31168350e-47 -6.52238100e-31  2.30600992e-31]
 [-3.76569842e-31  6.52238100e-31 -5.73220578e-47]
 [-4.31168350e-47 -6.52238100e-31  2.30600992e-31]]
stress =  [ 3.87641204e-10  3.87641204e-10  3.17789588e-10 -4.29803847e-26
  5.23592216e-26  1.18912452e-25]
energy per atom =  -20.944422664672967
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Prototype label changed during relaxation: test template prototype is A_hR1_166_a, while relaxed is A_cI2_229_a. Skipping parameter set 0.
No parameter sets in this group successfully added a property instance. Skipping this group.