element(s):
['He']
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:
['3.292']
model name:
TT_Modified_HellmannBichVogel_2007_He__MO_126942667206_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['He']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[3.292, 0, 0], [0, 3.292, 0], [0, 0, 3.292]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:59:59       -6.212401         8.271302
BFGS:    1 16:59:59       -7.597489        10.206165
BFGS:    2 16:59:59       -9.301574        12.601114
BFGS:    3 16:59:59      -11.412930        15.581730
BFGS:    4 16:59:59      -14.017338        19.277492
BFGS:    5 16:59:59      -17.241051        23.872207
BFGS:    6 16:59:59      -21.237313        29.591359
BFGS:    7 16:59:59      -26.190294        36.708487
BFGS:    8 16:59:59      -32.353426        45.597299
BFGS:    9 16:59:59      -39.992120        56.659215
BFGS:   10 16:59:59      -49.493220        70.472024
BFGS:   11 16:59:59      -61.319339        87.735977
BFGS:   12 16:59:59      -76.039282       109.319431
BFGS:   13 16:59:59      -94.397706       136.369842
BFGS:   14 16:59:59     -117.307032       170.312585
BFGS:   15 16:59:59     -145.957486       213.038310
BFGS:   16 16:59:59     -181.795629       266.883777
BFGS:   17 16:59:59     -226.751856       335.045383
BFGS:   18 16:59:59     -283.265513       421.673316
BFGS:   19 16:59:59     -354.498113       532.320254
BFGS:   20 16:59:59     -444.570571       674.492262
BFGS:   21 16:59:59     -558.987659       858.664859
BFGS:   22 16:59:59     -705.063629      1099.433363
BFGS:   23 16:59:59     -892.735083      1417.701252
BFGS:   24 17:00:00    -1135.877313      1844.459518
BFGS:   25 17:00:00    -1453.904371      2425.868596
BFGS:   26 17:00:00    -1875.058351      3233.845100
BFGS:   27 17:00:00    -2441.239038      4383.127899
BFGS:   28 17:00:00    -3216.660607      6063.693865
BFGS:   29 17:00:00    -4303.296180      8603.133476
BFGS:   30 17:00:01    -5869.900519     12593.644743
BFGS:   31 17:00:01    -8209.568737     19166.971793
BFGS:   32 17:00:01   -11861.963964     30637.453858
BFGS:   33 17:00:02   -14923.997364     49616.808864
BFGS:   34 17:00:02   -23008.683244     91567.286401
BFGS:   35 17:00:03   -43306.918984    194535.275243
BFGS:   36 17:00:04   -85335.975487    474924.473670
BFGS:   37 17:00:07  -200818.230805   1498227.361133
Minimization stalled after 37 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 14931578.205407983 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['He', 'He']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[0.24690000001051143, 1.7688758856458024e-32, -4.9173727797417956e-30], [2.3676859132660952e-32, 0.24690000001051016, -7.283793535988612e-17], [-1.1285630906496045e-29, -7.283793535987851e-17, 0.24690000001051068]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.49315782e+07  1.49315782e+07  1.49315782e+07 -9.80772834e-09
  2.22319781e-19  1.03576416e-36]
energy per atom =  -100409.11540232575
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0