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:
MEAM_LAMMPS_JeongParkDo_2018_PdCu__MO_353393547686_002
==== 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 00:17:20       -7.703398         0.893985
BFGS:    1 00:17:21       -7.733859         0.693115
BFGS:    2 00:17:21       -7.772424         0.151198
BFGS:    3 00:17:21       -7.773975         0.018762
BFGS:    4 00:17:21       -7.774000         0.000428
BFGS:    5 00:17:21       -7.774000         0.000001
BFGS:    6 00:17:21       -7.774000         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 6.410136855136139e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cu', 'Pd']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.939867574679541, -3.707586644306933e-33, -4.1165748986429444e-33], [-3.5172786436840934e-33, 2.939867574679541, 1.1979344150603764e-19], [5.1325924238482904e-33, 1.1979344150603018e-19, 2.939867574679541]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 6.41013686e-12  6.41013686e-12  6.41013686e-12 -3.43801330e-28
 -1.01732380e-59 -1.68770120e-60]
energy per atom =  -3.887000000165848
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0