element(s):
['Nd']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.144']
model name:
MEAM_LAMMPS_KimLee_2017_MgNd__MO_059320827436_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Nd']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[4.144, 0, 0], [0, 4.144, 0], [0, 0, 4.144]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:17:40       -6.312949         0.029896
BFGS:    1 16:17:40       -6.312985         0.026061
BFGS:    2 16:17:40       -6.313099         0.000191
BFGS:    3 16:17:40       -6.313099         0.000001
BFGS:    4 16:17:40       -6.313099         0.000000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.638411417217597e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Nd', 'Nd']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[4.15094309893702, -2.131964684312726e-37, 2.5328357981710657e-34], [1.978766661278561e-33, 4.15094309893702, 5.923512115494205e-22], [-5.153490549022602e-33, 5.9235121154942545e-22, 4.15094309893702]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.63841142e-12 -1.63841142e-12 -1.63841142e-12  1.52892633e-28
  3.72585261e-36 -2.46292874e-52]
energy per atom =  -3.1565496763839764
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0