element(s):
['Cu', 'Zr']
AFLOW prototype label:
AB_cP2_221_a_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.2717']
model name:
EMT_Asap_MetalGlass_PaduraruKenoufiBailey_2007_CuZr__MO_987541074959_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cu', 'Zr']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  221
cell =  [[3.2717, 0, 0], [0, 3.2717, 0], [0, 0, 3.2717]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 11:30:49      -10.044981         0.739078
BFGS:    1 11:30:49      -10.066096         0.592850
BFGS:    2 11:30:49      -10.100289         0.083624
BFGS:    3 11:30:49      -10.100888         0.007728
BFGS:    4 11:30:49      -10.100893         0.000089
BFGS:    5 11:30:49      -10.100893         0.000000
BFGS:    6 11:30:49      -10.100893         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 6.992399437139721e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cu', 'Zr']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.1923191116997383, -2.5558436899351635e-33, -4.328303989409804e-33], [-1.5964973540726555e-35, 3.1923191116997383, 3.5265506995571977e-22], [2.9366716428829325e-33, 3.526550699525048e-22, 3.1923191116997383]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 6.99239944e-14  6.99239944e-14  6.99239944e-14 -1.22932058e-29
  1.00792129e-34  5.45963050e-51]
energy per atom =  -5.0504467083187325
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0