element(s):
['Al']
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:
['4.039']
model name:
MEAM_LAMMPS_RoyDuttaChakraborti_2021_AlLi__MO_971738391444_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[4.039, 0, 0], [0, 4.039, 0], [0, 0, 4.039]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 11:14:21      -13.410926         0.066005
BFGS:    1 11:14:21      -13.411104         0.060226
BFGS:    2 11:14:21      -13.412000         0.000742
BFGS:    3 11:14:21      -13.412000         0.000008
BFGS:    4 11:14:22      -13.412000         0.000000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 7.361622115041775e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Al']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [1.84783734e-50 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.48605706e-36]]
cellpar =  Cell([[4.049999988209402, -1.6139847600293126e-36, -1.9021927590324504e-32], [3.9727371548261864e-36, 4.049999988209402, 6.258291384431635e-20], [-2.2619961943757818e-32, 6.258291384432448e-20, 4.049999988209402]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-7.36162212e-11 -7.36162212e-11 -7.36162212e-11 -1.63481325e-26
 -1.95694757e-36 -6.51849696e-52]
energy per atom =  -3.3530000001174085
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0