element(s):
['Pb']
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:
['3.975']
model name:
Morse_Shifted_GirifalcoWeizer_1959MedCutoff_Pb__MO_958424213898_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['Pb']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[3.975, 0, 0], [0, 3.975, 0], [0, 0, 3.975]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 18:07:42       -3.973255        0.2809
BFGS:    1 18:07:42       -3.976380        0.2381
BFGS:    2 18:07:42       -3.983832        0.0221
BFGS:    3 18:07:42       -3.983890        0.0015
BFGS:    4 18:07:42       -3.983890        0.0000
BFGS:    5 18:07:42       -3.983890        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.1440904106293224e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Pb', 'Pb']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.9261580987162237, -6.302499912460414e-33, 2.9971936005000218e-33], [-1.456139186537737e-33, 3.9261580987162237, -7.979468320224398e-20], [-4.1877005086708546e-33, -7.979468320224569e-20, 3.9261580987162237]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.14409041e-10 -1.14409041e-10 -1.14409041e-10 -3.81557338e-27
 -2.66540763e-34 -3.32945525e-51]
energy per atom =  -1.9919451579374383
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0