element(s):
['Ti']
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:
['3.0022', '1.5915662']
model name:
MEAM_LAMMPS_HennigLenoskyTrinkle_2008_Ti__MO_520569947398_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ti']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[3.0022, 0, 0], [-1.5011, 2.5999814672416, 0], [0, 0, 4.7782]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 14:14:55       -9.607225         0.767240
BFGS:    1 14:14:55       -9.629145         0.619485
BFGS:    2 14:14:55       -9.659842         0.185652
BFGS:    3 14:14:55       -9.662317         0.027320
BFGS:    4 14:14:55       -9.662356         0.009728
BFGS:    5 14:14:55       -9.662358         0.010042
BFGS:    6 14:14:55       -9.662366         0.006181
BFGS:    7 14:14:55       -9.662367         0.002119
BFGS:    8 14:14:55       -9.662368         0.000272
BFGS:    9 14:14:55       -9.662368         0.000020
BFGS:   10 14:14:55       -9.662368         0.000001
BFGS:   11 14:14:55       -9.662368         0.000000
BFGS:   12 14:14:55       -9.662368         0.000000
Minimization converged after 12 steps.
Maximum force component: 1.8436823656694787e-32 eV/Angstrom
Maximum stress component: 1.4222030756472436e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ti', 'Ti']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[2.930493721041335, 3.7707009581466255e-18, 6.351385128754556e-36], [-1.4652468605206674, 2.537882008052584, 2.4937108823023815e-35], [3.9274155645244186e-35, 1.3911115055531375e-35, 4.678286103685341]])
forces =  [[ 1.84368237e-32 -1.10789747e-32 -4.80536069e-33]
 [-1.80605619e-32  1.04272703e-32  4.80536069e-33]]
stress =  [ 1.42220308e-11  1.42220308e-11  7.64446798e-12  4.32564638e-35
  7.49223931e-35 -6.04381715e-27]
energy per atom =  -4.831183777795352
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0