element(s):
['He']
AFLOW prototype label:
A_hP1_191_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:
['2.8028', '0.97641644']
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 =  191
cell =  [[2.8028, 0, 0], [-1.4014, 2.427296001727, 0], [0, 0, 2.7367]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:37:08       -3.234913        8.8521
BFGS:    1 14:37:08       -4.713168       13.2961
BFGS:    2 14:37:08       -6.882980       20.0189
BFGS:    3 14:37:08      -10.091393       30.2022
BFGS:    4 14:37:08      -14.875769       45.6509
BFGS:    5 14:37:08      -22.058476       69.1540
BFGS:    6 14:37:08      -32.890394      104.9463
BFGS:    7 14:37:08      -49.201204      159.5517
BFGS:    8 14:37:08      -74.539488      244.1453
BFGS:    9 14:37:08     -106.805783      364.7800
BFGS:   10 14:37:08     -118.296397      383.9827
BFGS:   11 14:37:08     -176.056245      572.2375
BFGS:   12 14:37:08     -267.204350      876.9553
BFGS:   13 14:37:08     -416.717635     1399.3378
BFGS:   14 14:37:08     -675.218382     2368.5167
BFGS:   15 14:37:08    -1121.786134     4225.0204
BFGS:   16 14:37:08    -1944.606481     8160.6103
BFGS:   17 14:37:08    -3683.242626    18118.4407
BFGS:   18 14:37:08    -5902.362212    38492.2210
Minimization stalled after 18 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 60028.79073958567 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['He']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[0.4893134519598978, 1.0847433865588337e-17, -9.911585024521822e-33], [-0.2446567259799489, 0.42375787981072544, -8.284525412889e-33], [-3.01729439853948e-32, -3.2432476071983637e-32, 0.582688510249633]])
forces =  [[0. 0. 0.]]
stress =  [ 5.56194410e+04  5.56194410e+04  6.00287907e+04  8.76288875e-27
  5.41020595e-27 -1.58278254e-12]
energy per atom =  -5902.3622121909875
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0