element(s):
['La']
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:
['5.3757']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['La']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[5.3757, 0, 0], [0, 5.3757, 0], [0, 0, 5.3757]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:22:20      -68.874922        49.146214
BFGS:    1 15:22:20      -75.077163        34.036754
BFGS:    2 15:22:20      -79.235847        21.871242
BFGS:    3 15:22:20      -81.762752        12.193641
BFGS:    4 15:22:20      -82.994860         4.537352
BFGS:    5 15:22:20      -83.227913         0.796077
BFGS:    6 15:22:20      -83.236047         0.067729
BFGS:    7 15:22:20      -83.236107         0.001147
BFGS:    8 15:22:20      -83.236107         0.000002
BFGS:    9 15:22:20      -83.236107         0.000000
Minimization converged after 9 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 9.762770066024006e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['La', 'La', 'La', 'La']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [9.61402065e-49 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([[5.6935826621869285, 3.827924227988626e-32, -1.8149178752266877e-33], [5.167738086850137e-32, 5.6935826621869285, -1.8826621392482658e-17], [-1.670044235472565e-33, -1.8826621392482652e-17, 5.6935826621869285]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-9.76277007e-13 -9.76277007e-13 -9.76277007e-13  1.03700594e-30
  3.01017371e-34 -3.90594900e-52]
energy per atom =  -20.809026824305995
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0