element(s):
['La']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.2756']
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 =  229
cell =  [[4.2756, 0, 0], [0, 4.2756, 0], [0, 0, 4.2756]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:12:21      -31.056289        55.086529
BFGS:    1 16:12:21      -36.993152        26.197389
BFGS:    2 16:12:21      -39.320396         9.217111
BFGS:    3 16:12:21      -39.748607         2.627632
BFGS:    4 16:12:21      -39.792445         0.385932
BFGS:    5 16:12:21      -39.793474         0.021256
BFGS:    6 16:12:21      -39.793477         0.000186
BFGS:    7 16:12:21      -39.793477         0.000000
BFGS:    8 16:12:21      -39.793477         0.000000
Minimization converged after 8 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 9.200438462632203e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['La', 'La']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[4.556840983827549, 2.036580111407619e-32, -2.0768289984569913e-33], [1.6731115380067027e-32, 4.5568409838275485, 7.33979661526318e-18], [5.232135912088204e-33, 7.33979661526317e-18, 4.556840983827549]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-9.20043846e-15 -9.20043846e-15 -9.20043846e-15  4.17998171e-32
 -4.94665323e-34  8.10688659e-51]
energy per atom =  -19.896738673320428
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0