element(s):
['Pd', 'V']
AFLOW prototype label:
AB3_cP8_223_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:
['4.8451']
model name:
MEAM_LAMMPS_KoLee_2013_VPdY__MO_046547823135_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Pd', 'V']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.25 0.   0.5 ]]
spacegroup =  223
cell =  [[4.8451, 0, 0], [0, 4.8451, 0], [0, 0, 4.8451]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:44:29      -42.825684        0.1287
BFGS:    1 14:44:29      -42.826360        0.1160
BFGS:    2 14:44:29      -42.829304        0.0016
BFGS:    3 14:44:29      -42.829305        0.0000
BFGS:    4 14:44:29      -42.829305        0.0000
Minimization converged after 4 steps.
Maximum force component: 1.4965269514660415e-32 eV/Angstrom
Maximum stress component: 2.4117143057697297e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Pd', 'Pd', 'V', 'V', 'V', 'V', 'V', 'V']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [2.50000000e-01 7.74544635e-38 5.00000000e-01]
 [7.50000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 2.50000000e-01 9.68180794e-38]
 [5.00000000e-01 7.50000000e-01 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 2.50000000e-01]
 [0.00000000e+00 5.00000000e-01 7.50000000e-01]]
cellpar =  Cell([[4.856507618006144, 5.07618323866678e-33, 4.0552270416728254e-33], [-1.6916516263972505e-33, 4.856507618006144, -1.9859616021766997e-21], [-1.8427615416394414e-33, -1.985961602175854e-21, 4.856507618006144]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [-2.49421159e-33 -9.97684634e-33  4.07981111e-54]
 [ 5.36801850e-66 -9.97684634e-33 -4.98842317e-33]
 [-2.49421159e-33  9.97684634e-33  9.97684634e-33]
 [-4.98842317e-33 -7.48263476e-33  3.05985833e-54]
 [ 1.49652695e-32 -4.07981111e-54  9.97684634e-33]
 [ 5.52323295e-66 -4.98842317e-33 -9.97684634e-33]]
stress =  [-2.41171431e-10 -2.41171431e-10 -2.41171431e-10  1.67369857e-26
  2.61301748e-34  1.58040720e-50]
energy per atom =  -5.353663122905101
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0