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:
Sim_LAMMPS_MEAM_MaiselKoZhang_2017_VNiTi__SM_971529344487_000
==== 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 13:21:53      -42.150782         0.053907
BFGS:    1 13:21:54      -42.150902         0.049272
BFGS:    2 13:21:54      -42.151509         0.000295
BFGS:    3 13:21:54      -42.151509         0.000002
BFGS:    4 13:21:54      -42.151509         0.000000
Minimization converged after 4 steps.
Maximum force component: 7.753854758158162e-32 eV/Angstrom
Maximum stress component: 4.138383858046346e-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]
 [2.44894656e-40 5.00000000e-01 2.50000000e-01]
 [0.00000000e+00 5.00000000e-01 7.50000000e-01]]
cellpar =  Cell([[4.71800574636562, 9.252902669692749e-34, -2.3206471816072304e-34], [9.252912673965181e-34, 4.71800574636562, 1.2432592873985661e-21], [2.586707677448954e-34, 1.243259287400825e-21, 4.71800574636562]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 8.66618474e-66  3.87692738e-32  1.93846369e-32]
 [-5.92727406e-66 -1.93846369e-32 -3.87692738e-32]
 [ 2.36318174e-66  1.21153981e-33  3.87692738e-32]
 [-7.75385476e-32 -1.02162359e-53 -3.87692738e-32]
 [ 3.87692738e-32  3.87692738e-32  1.02162359e-53]
 [-3.87692738e-32 -5.81539107e-32 -1.53243539e-53]]
stress =  [-4.13838386e-12 -4.13838386e-12 -4.13838386e-12  4.05427887e-30
  4.03766549e-35 -1.01604893e-52]
energy per atom =  -5.268938661974188
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0