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 12:27:48       -9.749329         1.992134
BFGS:    1 12:27:48       -9.904090         1.622340
BFGS:    2 12:27:48      -10.088715         0.799907
BFGS:    3 12:27:48      -10.132076         0.250879
BFGS:    4 12:27:48      -10.135959         0.025175
BFGS:    5 12:27:48      -10.136000         0.000687
BFGS:    6 12:27:48      -10.136000         0.000002
BFGS:    7 12:27:48      -10.136000         0.000000
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, -7.947948096406918e-33, 1.8258149462286946e-34], [-7.13339456121956e-33, 2.9213923789511576, 1.934330115464375e-17], [1.4327984785049702e-33, 1.934330115464375e-17, 2.9213923789511576]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.14425260e-11  1.14425260e-11  1.14425260e-11  2.88347339e-28
  2.67072667e-60 -2.05824201e-60]
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