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 17:23:59      -87.334940       25.2343
BFGS:    1 17:23:59      -90.240046       13.9457
BFGS:    2 17:23:59      -91.638868        5.0651
BFGS:    3 17:23:59      -91.889691        0.8973
BFGS:    4 17:23:59      -91.898611        0.0755
BFGS:    5 17:23:59      -91.898676        0.0013
BFGS:    6 17:23:59      -91.898676        0.0000
BFGS:    7 17:23:59      -91.898676        0.0000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.32459528723319e-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([[5.226002249322444, -2.6107605319886236e-33, -1.5093892498636917e-32], [6.138247757175702e-34, 5.226002249322444, -1.9667430855320467e-18], [-2.246784183339572e-32, -1.9667430855320205e-18, 5.226002249322444]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.32459529e-12 -1.32459529e-12 -1.32459529e-12 -1.20353832e-27
 -2.32910078e-60 -1.18196681e-61]
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