element(s):
['Rb']
AFLOW prototype label:
A_tI2_139_a
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.793', '0.92463318']
model name:
Sim_LAMMPS_EIM_Zhou_2010_BrClCsFIKLiNaRb__SM_259779394709_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Rb']
representative atom coordinates =  [[0 0 0]]
spacegroup =  139
cell =  [[5.793, 0, 0], [0, 5.793, 0], [0, 0, 5.3564]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:10:09       -1.642491        0.4982
BFGS:    1 17:10:09       -1.650675        0.4579
BFGS:    2 17:10:09       -1.683409        0.1090
BFGS:    3 17:10:09       -1.684393        0.1474
BFGS:    4 17:10:09       -1.684745        0.1415
BFGS:    5 17:10:09       -1.690289        0.0528
BFGS:    6 17:10:09       -1.691291        0.0115
BFGS:    7 17:10:10       -1.691328        0.0011
BFGS:    8 17:10:10       -1.691328        0.0000
BFGS:    9 17:10:10       -1.691328        0.0000
BFGS:   10 17:10:10       -1.691328        0.0000
Minimization converged after 10 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.561462957058076e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Rb', 'Rb']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[5.487757384332094, 3.1197456324422408e-34, 5.95354725212681e-32], [3.8407439816900704e-34, 5.4877573843320935, 1.586509367724029e-18], [-9.266543959761976e-33, 1.3012038692095829e-18, 5.487757384212217]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 2.56146296e-12  2.56146296e-12  1.97380841e-12 -4.36628681e-28
  1.02322387e-34 -2.90989403e-50]
energy per atom =  -0.8456642074715406
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Prototype label changed during relaxation: test template prototype is A_tI2_139_a, while relaxed is A_cI2_229_a. Skipping parameter set 0.
No parameter sets in this group successfully added a property instance. Skipping this group.