element(s):
['Co']
AFLOW prototype label:
A_hP2_194_c
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.5032', '1.5893656']
model name:
MEAM_LAMMPS_OhSeolLee_2020_CoTi__MO_862371677648_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Co']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[2.5032, 0, 0], [-1.2516, 2.1678347907532, 0], [0, 0, 3.9785]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:50:45       -8.804731        0.5807
BFGS:    1 14:50:45       -8.809938        0.4480
BFGS:    2 14:50:45       -8.816714        0.0942
BFGS:    3 14:50:45       -8.817153        0.0989
BFGS:    4 14:50:45       -8.818152        0.0651
BFGS:    5 14:50:45       -8.818387        0.0234
BFGS:    6 14:50:45       -8.818427        0.0056
BFGS:    7 14:50:45       -8.818428        0.0004
BFGS:    8 14:50:45       -8.818428        0.0000
BFGS:    9 14:50:45       -8.818428        0.0000
BFGS:   10 14:50:45       -8.818428        0.0000
Minimization converged after 10 steps.
Maximum force component: 6.168667666147661e-32 eV/Angstrom
Maximum stress component: 5.449865078894503e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Co']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[2.502308886272177, -3.6854710535834247e-19, 5.198761829633133e-37], [-1.2511544431360886, 2.1670630636272517, 1.4747396605654296e-36], [1.9843633138661893e-36, 6.192969434180101e-36, 4.075717475598191]])
forces =  [[-6.16866767e-32  3.56148194e-32 -8.37284942e-33]
 [ 6.16866767e-32 -3.56148194e-32  8.37284942e-33]]
stress =  [-2.06397739e-10 -2.06397739e-10 -5.44986508e-10 -1.51184387e-33
 -1.00715015e-33 -8.90883751e-26]
energy per atom =  -4.409213994034341
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0