element(s):
['K']
AFLOW prototype label:
A_cP1_221_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.2844']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['K']
representative atom coordinates =  [[0 0 0]]
spacegroup =  221
cell =  [[4.2844, 0, 0], [0, 4.2844, 0], [0, 0, 4.2844]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 20:42:31       -2.373313         3.043661
BFGS:    1 20:42:31       -2.754928         2.662134
BFGS:    2 20:42:31       -3.019260         0.353563
BFGS:    3 20:42:31       -3.020004         0.307666
BFGS:    4 20:42:31       -3.021473         0.028251
BFGS:    5 20:42:31       -3.021486         0.001057
BFGS:    6 20:42:31       -3.021486         0.000004
BFGS:    7 20:42:31       -3.021486         0.000000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 8.096519651082857e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['K']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[3.865014224113962, 7.441464894405107e-33, 3.297225292065307e-33], [-3.239672424350036e-33, 3.865014224113962, 8.87656445241094e-18], [7.036797288083401e-33, 8.876564452410951e-18, 3.8650142241139624]])
forces =  [[0. 0. 0.]]
stress =  [8.09651965e-12 8.09651965e-12 8.09651965e-12 1.32747791e-27
 1.07437785e-36 2.68314785e-52]
energy per atom =  -3.0214857539972355
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0