element(s):
['C']
AFLOW prototype label:
A_hP4_194_f
Parameter names:
['a', 'c/a', 'z1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.5124', '1.6642254', '0.062750617']
model name:
DUNN_WenTadmor_2019v2_C__MO_956135237832_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0.33333333 0.66666667 0.06275062]]
spacegroup =  194
cell =  [[2.5124, 0, 0], [-1.2562, 2.175802224468, 0], [0, 0, 4.1812]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:30:34      -31.199396         0.491884
BFGS:    1 15:30:34      -31.212114         0.432455
BFGS:    2 15:30:34      -31.239208         0.090084
BFGS:    3 15:30:34      -31.239727         0.094542
BFGS:    4 15:30:34      -31.241995         0.104322
BFGS:    5 15:30:34      -31.242192         0.094523
BFGS:    6 15:30:34      -31.243158         0.022033
BFGS:    7 15:30:34      -31.243227         0.006555
BFGS:    8 15:30:35      -31.243233         0.000191
BFGS:    9 15:30:35      -31.243233         0.000014
BFGS:   10 15:30:35      -31.243233         0.000000
BFGS:   11 15:30:35      -31.243233         0.000000
BFGS:   12 15:30:35      -31.243233         0.000000
Minimization converged after 12 steps.
Maximum force component: 3.153575018851642e-10 eV/Angstrom
Maximum stress component: 9.614946190677546e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C']
basis =  [[0.33333333 0.66666667 0.05757773]
 [0.66666666 0.33333334 0.55757773]
 [0.66666666 0.33333334 0.94242227]
 [0.33333333 0.66666667 0.44242227]]
cellpar =  Cell([[2.550438599853911, 2.2807972246411125e-18, 1.6458614795771737e-37], [-1.2752192999269556, 2.2087446182659023, 1.4506509925196253e-36], [9.625417483185792e-37, 1.1578368865162861e-36, 4.1501495044809085]])
forces =  [[ 1.04788610e-31 -1.81499196e-32  3.15357502e-10]
 [-6.28731657e-32 -1.81499196e-31  3.15357502e-10]
 [ 1.04788610e-32  1.08899517e-31 -3.15357502e-10]
 [ 2.51492663e-31 -1.45199357e-31 -3.15357502e-10]]
stress =  [-8.41073527e-11 -8.41073527e-11  9.61494619e-11 -8.96437373e-33
  3.10535015e-33 -9.72077375e-27]
energy per atom =  -0.44824975886606744
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0