element(s):
['Al', 'Li']
AFLOW prototype label:
A3B_cP4_221_c_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.0255']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Li']
representative atom coordinates =  [[0.  0.5 0.5]
 [0.  0.  0. ]]
spacegroup =  221
cell =  [[4.0255, 0, 0], [0, 4.0255, 0], [0, 0, 4.0255]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 01:28:52      -41.123648       16.5609
BFGS:    1 01:28:52      -43.666271       17.3341
BFGS:    2 01:28:52      -46.321214       18.0536
BFGS:    3 01:28:52      -49.078021       18.6860
BFGS:    4 01:28:52      -51.925412       19.2398
BFGS:    5 01:28:52      -54.838613       19.5793
BFGS:    6 01:28:52      -57.783709       19.6443
BFGS:    7 01:28:52      -60.713536       19.3805
BFGS:    8 01:28:52      -63.569263       18.6035
BFGS:    9 01:28:53      -66.262575       17.1847
BFGS:   10 01:28:53      -68.682334       14.9171
BFGS:   11 01:28:53      -70.692028       11.6628
BFGS:   12 01:28:53      -72.099898        6.8319
BFGS:   13 01:28:53      -72.650357        0.2111
BFGS:   14 01:28:53      -72.650766        0.0407
BFGS:   15 01:28:53      -72.650781        0.0002
BFGS:   16 01:28:53      -72.650781        0.0000
BFGS:   17 01:28:53      -72.650781        0.0000
Minimization converged after 17 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.6716581805355727e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Li']
basis =  [[0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.10319019e-16 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.10319019e-16]
 [0.00000000e+00 1.10319019e-16 1.10319019e-16]]
cellpar =  Cell([[3.3700096919409464, -8.690141929323082e-33, -3.990211695795792e-33], [-1.9865107165293578e-32, 3.3700096919409464, 6.521556607999845e-19], [4.969967832047164e-33, 6.521556607999809e-19, 3.3700096919409464]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.67165818e-14 -2.67165818e-14 -2.67165818e-14  6.95251936e-33
 -1.44709451e-33  7.25243084e-51]
energy per atom =  -18.16269533027283
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0