element(s):
['F', 'K']
AFLOW prototype label:
AB_cF8_225_a_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.4191']
model name:
Sim_LAMMPS_EIM_Zhou_2010_BrClCsFIKLiNaRb__SM_259779394709_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['F', 'K']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[5.4191, 0, 0], [0, 5.4191, 0], [0, 0, 5.4191]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 13:02:52      -30.458107         0.859455
BFGS:    1 13:02:52      -30.488705         0.805725
BFGS:    2 13:02:52      -30.586977         0.499140
BFGS:    3 13:02:52      -30.636874         0.160635
BFGS:    4 13:02:53      -30.642321         0.025245
BFGS:    5 13:02:53      -30.642484         0.007227
BFGS:    6 13:02:53      -30.642494         0.000952
BFGS:    7 13:02:53      -30.642494         0.000070
BFGS:    8 13:02:53      -30.642494         0.000001
BFGS:    9 13:02:53      -30.642494         0.000000
Minimization converged after 9 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.931051092830242e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['F', 'F', 'F', 'F', 'K', 'K', 'K', 'K']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 3.61706216e-35]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 3.61706216e-35]
 [0.00000000e+00 3.61706216e-35 5.00000000e-01]]
cellpar =  Cell([[5.324569668084835, 2.2262877286836247e-32, -3.108155085304865e-33], [4.686542273568639e-32, 5.324569668084835, 2.0881881896250296e-18], [7.717157613977505e-34, 2.0881881896250257e-18, 5.324569668084835]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.93105109e-11  1.93105109e-11  1.93105109e-11 -1.98536677e-28
  7.24603090e-35 -1.37655982e-51]
energy per atom =  -3.830311741224091
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Skipping parameter set 0 because of error while adding or validating property:
 
ERROR(@kim_property_modify): input value "Rock Salt" doesn't meet the format specification. An integer equal to or greater than 1 or integer indices range of "start:stop".
No parameter sets in this group successfully added a property instance. Skipping this group.