element(s):
['Li']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.3176']
model name:
MEAM_LAMMPS_RoyDuttaChakraborti_2021_AlLi__MO_971738391444_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Li']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[4.3176, 0, 0], [0, 4.3176, 0], [0, 0, 4.3176]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:02:14       -6.591934        0.3307
BFGS:    1 17:02:14       -6.596561        0.3222
BFGS:    2 17:02:14       -6.638303        0.2354
BFGS:    3 17:02:14       -6.667473        0.1545
BFGS:    4 17:02:14       -6.684943        0.0793
BFGS:    5 17:02:14       -6.691537        0.0095
BFGS:    6 17:02:14       -6.691637        0.0004
BFGS:    7 17:02:14       -6.691637        0.0000
BFGS:    8 17:02:14       -6.691637        0.0000
Minimization converged after 8 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.085503340913683e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Li', 'Li', 'Li', 'Li']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [7.52526475e-50 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[4.546203941937393, 9.74296541598687e-34, -3.8609028012438894e-33], [1.9828221756229027e-33, 4.546203941937393, -1.0053979866489703e-17], [-6.224654146196456e-34, -1.0053979866489706e-17, 4.546203941937393]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.08550334e-11 -2.08550334e-11 -2.08550334e-11  1.95466560e-27
  2.40865268e-38 -1.52283755e-54]
energy per atom =  -1.6729092082053363
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0