element(s):
['Al', 'Li']
AFLOW prototype label:
AB_cF16_227_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:
['6.365']
model name:
MEAM_LAMMPS_RoyDuttaChakraborti_2021_AlLi__MO_971738391444_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Li']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  227
cell =  [[6.365, 0, 0], [0, 6.365, 0], [0, 0, 6.365]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 20:03:15      -31.632408         0.094979
BFGS:    1 20:03:15      -31.632793         0.093883
BFGS:    2 20:03:15      -31.643872         0.054007
BFGS:    3 20:03:15      -31.649046         0.015158
BFGS:    4 20:03:15      -31.649497         0.000274
BFGS:    5 20:03:16      -31.649497         0.000001
BFGS:    6 20:03:16      -31.649497         0.000000
Minimization converged after 6 steps.
Maximum force component: 1.8321277784639386e-32 eV/Angstrom
Maximum stress component: 8.339619819581758e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li']
basis =  [[1.60496320e-33 4.71196511e-38 1.58908587e-33]
 [1.21975866e-33 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 0.00000000e+00 5.00000000e-01]
 [6.42133381e-35 5.00000000e-01 0.00000000e+00]
 [2.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 7.50000000e-01 7.50000000e-01]
 [7.50000000e-01 2.50000000e-01 2.50000000e-01]
 [2.50000000e-01 2.50000000e-01 7.50000000e-01]]
cellpar =  Cell([[6.413225601271484, 8.007043836057875e-35, 1.7441198747015127e-34], [2.0051894681742238e-35, 6.413225601271484, 2.7973817488472763e-19], [-6.520197726227351e-34, 2.7973817488473986e-19, 6.413225601271484]])
forces =  [[ 1.83212778e-32  6.58742572e-33  1.15279950e-32]
 [ 9.46942447e-33 -8.23428215e-33 -3.08785581e-33]
 [ 1.64685643e-33  3.29371286e-33  3.29371286e-33]
 [ 8.23428215e-33 -2.47028465e-33  1.24543518e-32]
 [-1.64685643e-33 -3.29371286e-33  4.14296409e-33]
 [-5.35228340e-33  6.58742572e-33 -1.64685643e-32]
 [ 1.23514232e-32  6.58742572e-33  8.23428215e-34]
 [ 1.15279950e-32  1.19397091e-32  9.88113858e-33]
 [-2.05857054e-33  4.11714108e-33  3.29371286e-33]
 [-1.10905488e-32  8.97926879e-53  2.05857054e-33]
 [ 2.67614170e-33  2.15502451e-52  4.94056929e-33]
 [-4.94056929e-33 -6.63888998e-33 -2.89581419e-52]
 [ 4.52885518e-33  4.94056929e-33  3.91128402e-33]
 [ 7.41085394e-33  4.11714108e-33 -8.23428215e-33]
 [ 8.23428215e-34 -2.47028465e-33  4.11714108e-33]
 [ 6.48449719e-33 -2.51419526e-52 -5.76399751e-33]]
stress =  [-8.33961982e-12 -8.33961982e-12 -8.33961982e-12  3.60772910e-27
  6.24347227e-36 -1.43635386e-51]
energy per atom =  -1.9780935720668997
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0