element(s):
['Fe', 'Pd']
AFLOW prototype label:
AB3_cP4_221_a_c
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.9005']
model name:
MEAM_LAMMPS_JeongParkDo_2018_PdFe__MO_924736622203_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Fe', 'Pd']
representative atom coordinates =  [[0.  0.  0. ]
 [0.  0.5 0.5]]
spacegroup =  221
cell =  [[3.9005, 0, 0], [0, 3.9005, 0], [0, 0, 3.9005]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 11:19:53      -16.327907         0.609393
BFGS:    1 11:19:53      -16.342674         0.520984
BFGS:    2 11:19:53      -16.379777         0.042624
BFGS:    3 11:19:53      -16.379998         0.003495
BFGS:    4 11:19:53      -16.380000         0.000021
BFGS:    5 11:19:53      -16.380000         0.000000
BFGS:    6 11:19:53      -16.380000         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.5266355160382817e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Pd', 'Pd', 'Pd']
basis =  [[0.  0.  0. ]
 [0.  0.5 0.5]
 [0.5 0.  0.5]
 [0.5 0.5 0. ]]
cellpar =  Cell([[3.8466608907341278, -2.936642769228713e-33, 9.98355811743353e-34], [-2.888409100952312e-33, 3.8466608907341278, -9.00332405606106e-19], [-9.197995124514133e-34, -9.003324056061138e-19, 3.8466608907341278]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.52663552e-15  1.52663552e-15  1.52663552e-15 -4.53825588e-33
  6.94178901e-35 -2.19514313e-52]
energy per atom =  -4.09500000033981
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0