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 14:43:08       -6.834122        1.0477
BFGS:    1 14:43:08       -6.875733        0.8109
BFGS:    2 14:43:08       -6.948962        0.1508
BFGS:    3 14:43:08       -6.950803        0.0483
BFGS:    4 14:43:08       -6.950992        0.0027
BFGS:    5 14:43:08       -6.950992        0.0000
BFGS:    6 14:43:08       -6.950992        0.0000
BFGS:    7 14:43:08       -6.950992        0.0000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.7881617760848915e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Pd']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.1849974433625587, -1.61329449557483e-32, 1.1502051300195863e-32], [-3.003813991651824e-32, 3.1849974433625587, 1.711744201893382e-17], [-1.9674236822425546e-32, 1.7117442018933863e-17, 3.1849974433625587]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.78816178e-14 -2.78816178e-14 -2.78816178e-14  2.15028967e-30
 -6.07536378e-34  2.69816594e-50]
energy per atom =  -3.475496172332601
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0