element(s):
['Ni', '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:
['4.7127']
model name:
MEAM_LAMMPS_MaiselKoZhang_2017_VNiTi__MO_744610363128_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ni', 'V']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.25 0.   0.5 ]]
spacegroup =  223
cell =  [[4.7127, 0, 0], [0, 4.7127, 0], [0, 0, 4.7127]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 11:19:54      -42.150782         0.053907
BFGS:    1 11:19:54      -42.150902         0.049272
BFGS:    2 11:19:54      -42.151509         0.000295
BFGS:    3 11:19:54      -42.151509         0.000002
BFGS:    4 11:19:54      -42.151509         0.000000
Minimization converged after 4 steps.
Maximum force component: 1.938463689539525e-32 eV/Angstrom
Maximum stress component: 4.138598773914548e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni', '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 0.00000000e+00 5.00000000e-01]
 [7.50000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 2.50000000e-01 0.00000000e+00]
 [5.00000000e-01 7.50000000e-01 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 2.50000000e-01]
 [2.15239433e-42 5.00000000e-01 7.50000000e-01]]
cellpar =  Cell([[4.718005746365582, 9.39825464721329e-39, 4.719915491925046e-33], [3.4834222161949056e-33, 4.718005746365582, 2.3788482741394374e-21], [-7.021713904170586e-33, 2.378848274149888e-21, 4.718005746365582]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [-2.42307961e-33 -9.69231845e-33 -4.88692813e-54]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 2.88497687e-65 -9.77385627e-54 -1.93846369e-32]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [-1.93846369e-32  9.69231845e-33  4.88692813e-54]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]]
stress =  [-4.13859877e-12 -4.13859877e-12 -4.13859877e-12  8.16008974e-28
 -8.07533097e-35 -9.46777181e-51]
energy per atom =  -5.268938661974184
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0