element(s):
['Al', 'Pd']
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:
['3.0717']
model name:
EMT_Asap_Standard_JacobsenStoltzeNorskov_1996_AlAgAuCuNiPdPt__MO_115316750986_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Pd']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  221
cell =  [[3.0717, 0, 0], [0, 3.0717, 0], [0, 0, 3.0717]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 12:20:38       -6.834122         1.047712
BFGS:    1 12:20:38       -6.875733         0.810882
BFGS:    2 12:20:38       -6.948962         0.150804
BFGS:    3 12:20:38       -6.950803         0.048252
BFGS:    4 12:20:38       -6.950992         0.002665
BFGS:    5 12:20:38       -6.950992         0.000039
BFGS:    6 12:20:38       -6.950992         0.000000
BFGS:    7 12:20:38       -6.950992         0.000000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.5073067651999894e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Pd']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.18499744336256, -5.178350998152082e-33, -1.8825332689215293e-33], [-6.306768371212164e-33, 3.18499744336256, 1.6381721717951345e-17], [-3.358145023527183e-33, 1.638172171795135e-17, 3.18499744336256]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.50730677e-14 -2.50730677e-14 -2.50730677e-14  1.18699271e-30
  1.62009701e-33  6.31724475e-51]
energy per atom =  -3.4754961723326163
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0