element(s):
['Co', '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:
['3.1022']
model name:
MEAM_LAMMPS_OhSeolLee_2020_CoTi__MO_862371677648_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Co', 'Ti']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  221
cell =  [[3.1022, 0, 0], [0, 3.1022, 0], [0, 0, 3.1022]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:50:20       -9.749329        1.9921
BFGS:    1 14:50:20       -9.904090        1.6223
BFGS:    2 14:50:20      -10.088715        0.7999
BFGS:    3 14:50:20      -10.132076        0.2509
BFGS:    4 14:50:20      -10.135959        0.0252
BFGS:    5 14:50:20      -10.136000        0.0007
BFGS:    6 14:50:20      -10.136000        0.0000
BFGS:    7 14:50:20      -10.136000        0.0000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.1442526002220659e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Ti']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.9213923789511576, -6.017234459990464e-33, -6.077367669153682e-35], [-5.898248712609045e-33, 2.9213923789511576, 1.9428845952666418e-17], [-1.4368041659516273e-35, 1.9428845952666424e-17, 2.9213923789511576]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.14425260e-11  1.14425260e-11  1.14425260e-11  3.98975081e-30
 -2.40707391e-34 -1.88034964e-51]
energy per atom =  -5.06799992590753
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0