element(s):
['N', 'Ti']
AFLOW prototype label:
AB_cF8_225_a_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.3117']
model name:
Sim_LAMMPS_MEAM_AlmyrasSangiovanniSarakinos_2019_NAlTi__SM_871795249052_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['N', 'Ti']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[4.3117, 0, 0], [0, 4.3117, 0], [0, 0, 4.3117]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:49:18      -52.786753         0.708186
BFGS:    1 15:49:18      -52.807336         0.647984
BFGS:    2 15:49:18      -52.881528         0.337647
BFGS:    3 15:49:18      -52.907521         0.005131
BFGS:    4 15:49:18      -52.907527         0.000180
BFGS:    5 15:49:18      -52.907527         0.000000
BFGS:    6 15:49:19      -52.907527         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.6984814568562835e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['N', 'N', 'N', 'N', 'Ti', 'Ti', 'Ti', 'Ti']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [4.02302395e-50 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 2.21168081e-38 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 4.42336161e-38]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 3.14298746e-52]
 [0.00000000e+00 5.00000000e-01 6.63504242e-38]
 [1.85522816e-71 0.00000000e+00 5.00000000e-01]]
cellpar =  Cell([[4.2519493698858835, 1.9946196674583834e-33, -8.342342257049531e-36], [1.7833351401871182e-33, 4.2519493698858835, 1.289405145145545e-21], [-1.8415018631630855e-34, 1.2894051451451784e-21, 4.2519493698858835]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.69848146e-13  1.69848146e-13  1.69848146e-13 -2.27470090e-30
  1.42037511e-35  9.68116426e-53]
energy per atom =  -6.613440830960429
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0