element(s):
['N', 'Ti']
AFLOW prototype label:
AB_cP2_221_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:
['2.6986']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['N', 'Ti']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  221
cell =  [[2.6986, 0, 0], [0, 2.6986, 0], [0, 0, 2.6986]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 12:33:41      -31.077922        20.111359
BFGS:    1 12:33:41      -32.862467         4.912268
BFGS:    2 12:33:41      -33.014086         1.519509
BFGS:    3 12:33:41      -33.031527         0.104242
BFGS:    4 12:33:41      -33.031614         0.004026
BFGS:    5 12:33:41      -33.031614         0.000011
BFGS:    6 12:33:41      -33.031614         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.1615868250496723e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['N', 'Ti']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.7983830668349787, -1.1153317300935772e-33, 1.1718386277723432e-33], [-7.575528107903289e-34, 2.7983830668349787, -2.363866666082376e-18], [-9.283705740264378e-33, -2.3638666660823665e-18, 2.7983830668349787]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.16158683e-10 -1.16158683e-10 -1.16158683e-10 -4.45546392e-26
 -5.24668362e-34 -1.66832823e-49]
energy per atom =  -16.51580689593456
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0