element(s):
['Cd']
AFLOW prototype label:
A_hP2_194_c
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:
['3.0419', '1.8324403']
model name:
SW_WangStroudMarkworth_1989_CdTe__MO_786496821446_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cd']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[3.0419, 0, 0], [-1.52095, 2.6343626757719, 0], [0, 0, 5.5741]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 10:57:46        6.271009        20.659463
BFGS:    1 10:57:47        3.772630        16.216388
BFGS:    2 10:57:47        1.790451        12.197031
BFGS:    3 10:57:47        0.384825         9.275010
BFGS:    4 10:57:47       -0.588624         6.676069
BFGS:    5 10:57:47       -1.227302         4.371869
BFGS:    6 10:57:47       -1.599178         2.365650
BFGS:    7 10:57:47       -1.758428         0.687422
BFGS:    8 10:57:47       -1.775180         0.264733
BFGS:    9 10:57:47       -1.776953         0.329869
BFGS:   10 10:57:47       -1.779850         0.350202
BFGS:   11 10:57:47       -1.783205         0.261780
BFGS:   12 10:57:48       -1.785049         0.095336
BFGS:   13 10:57:48       -1.785318         0.023500
BFGS:   14 10:57:48       -1.785345         0.003166
BFGS:   15 10:57:48       -1.785347         0.000537
BFGS:   16 10:57:48       -1.785347         0.000039
BFGS:   17 10:57:48       -1.785347         0.000000
BFGS:   18 10:57:48       -1.785347         0.000000
Minimization converged after 18 steps.
Maximum force component: 1.357261693051032e-32 eV/Angstrom
Maximum stress component: 1.2123865559737019e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cd', 'Cd']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[3.645158081916484, 2.5915152651779363e-17, 2.0957478929382366e-35], [-1.822579040958242, 3.1567994997498334, 1.8607126505086223e-34], [-1.2212351520956176e-34, 1.8401228846345834e-34, 5.95251822462501]])
forces =  [[ 1.35726169e-32 -5.67445637e-33 -2.75271007e-67]
 [-9.36042547e-33  3.24254650e-33  1.48071973e-67]]
stress =  [-1.21238656e-10 -1.21238656e-10  1.35620786e-11 -4.37302004e-34
  1.00778836e-45  2.87069220e-26]
energy per atom =  -0.8926734147537567
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0