element(s):
['Cu', '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:
['3.015']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cu', 'Pd']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  221
cell =  [[3.015, 0, 0], [0, 3.015, 0], [0, 0, 3.015]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 12:27:35      -26.525271         3.118534
BFGS:    1 12:27:35      -26.479774         4.387030
BFGS:    2 12:27:35      -26.625690         0.407555
BFGS:    3 12:27:35      -26.627305         0.062066
BFGS:    4 12:27:35      -26.627340         0.003818
BFGS:    5 12:27:35      -26.627340         0.000008
BFGS:    6 12:27:35      -26.627340         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 6.907009465682433e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cu', 'Pd']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.983193725515152, 3.4647544449935704e-33, 8.30872021074025e-34], [-8.558066049327279e-33, 2.983193725515152, -1.7916933905401926e-18], [-8.415497784075649e-33, -1.7916933905401864e-18, 2.983193725515152]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [6.90700947e-11 6.90700947e-11 6.90700947e-11 3.50890933e-27
 1.15418732e-33 1.51616574e-50]
energy per atom =  -13.313670172854257
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0