element(s):
['Y']
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:
['5.0551']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Y']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[5.0551, 0, 0], [0, 5.0551, 0], [0, 0, 5.0551]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:22:59      -87.334940        25.234273
BFGS:    1 15:22:59      -90.240046        13.945692
BFGS:    2 15:22:59      -91.638868         5.065127
BFGS:    3 15:22:59      -91.889691         0.897335
BFGS:    4 15:22:59      -91.898611         0.075468
BFGS:    5 15:22:59      -91.898676         0.001274
BFGS:    6 15:22:59      -91.898676         0.000002
BFGS:    7 15:22:59      -91.898676         0.000000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.3210481567722796e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Y', 'Y', 'Y', 'Y']
basis =  [[0.  0.  0. ]
 [0.  0.5 0.5]
 [0.5 0.  0.5]
 [0.5 0.5 0. ]]
cellpar =  Cell([[5.226002249322445, 4.664588826638945e-33, -1.382218432966099e-32], [1.8629832401809728e-33, 5.226002249322445, 2.991312777913253e-18], [1.0789500795169747e-32, 2.991312777913181e-18, 5.226002249322445]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.32104816e-12 -1.32104816e-12 -1.32104816e-12 -4.28776813e-29
 -3.00877711e-34  1.29613154e-50]
energy per atom =  -22.974669073333143
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0