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 15:52:37      -22.262500       12.3907
BFGS:    1 15:52:37      -24.182796       13.2708
BFGS:    2 15:52:37      -26.236611       14.1782
BFGS:    3 15:52:37      -28.418632       14.9369
BFGS:    4 15:52:37      -30.704525       15.5294
BFGS:    5 15:52:37      -33.065075       15.9177
BFGS:    6 15:52:37      -35.443488       15.8353
BFGS:    7 15:52:37      -37.752332       15.1563
BFGS:    8 15:52:37      -39.872895       13.5545
BFGS:    9 15:52:37      -41.635341       10.7774
BFGS:   10 15:52:37      -42.819624        6.4262
BFGS:   11 15:52:37      -43.237173        0.7403
BFGS:   12 15:52:37      -43.249080        0.8079
BFGS:   13 15:52:37      -43.319045        2.1350
BFGS:   14 15:52:37      -43.479433        2.7667
BFGS:   15 15:52:37      -43.756561        4.8866
BFGS:   16 15:52:37      -44.073919        5.4788
BFGS:   17 15:52:37      -44.539999        7.7852
BFGS:   18 15:52:37      -45.070903        9.4278
BFGS:   19 15:52:37      -45.667270       10.6959
BFGS:   20 15:52:37      -46.375538       12.4235
BFGS:   21 15:52:37      -47.194529       14.4625
BFGS:   22 15:52:37      -48.125665       16.6231
BFGS:   23 15:52:37      -49.174782       19.0049
BFGS:   24 15:52:37      -50.349652       21.5552
BFGS:   25 15:52:37      -51.658388       24.1613
BFGS:   26 15:52:37      -53.095831       26.8562
BFGS:   27 15:52:37      -54.663618       29.2894
BFGS:   28 15:52:37      -56.324675       30.9836
BFGS:   29 15:52:37      -58.040832       31.5324
BFGS:   30 15:52:37      -59.798558       29.9774
BFGS:   31 15:52:37      -61.452164       24.7563
BFGS:   32 15:52:37      -62.416773        9.5428
BFGS:   33 15:52:37      -62.790277        6.0524
BFGS:   34 15:52:37      -62.805079        6.0845
BFGS:   35 15:52:37      -62.833156        0.3666
BFGS:   36 15:52:37      -62.833268        0.0224
BFGS:   37 15:52:37      -62.833268        0.0001
BFGS:   38 15:52:37      -62.833268        0.0000
BFGS:   39 15:52:37      -62.833268        0.0000
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.