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:
Morse_Shifted_GirifalcoWeizer_1959MedCutoff_Rb__MO_147245690895_004
==== 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 16:21:10       -1.741331         0.024322
BFGS:    1 16:21:10       -1.741342         0.024149
BFGS:    2 16:21:10       -1.742378         0.011194
BFGS:    3 16:21:10       -1.742704         0.012453
BFGS:    4 16:21:10       -1.742745         0.012517
BFGS:    5 16:21:10       -1.742752         0.012221
BFGS:    6 16:21:10       -1.742791         0.009604
BFGS:    7 16:21:10       -1.742827         0.007265
BFGS:    8 16:21:10       -1.742858         0.003281
BFGS:    9 16:21:10       -1.742870         0.000535
BFGS:   10 16:21:10       -1.742871         0.000205
BFGS:   11 16:21:10       -1.742871         0.000026
BFGS:   12 16:21:10       -1.742871         0.000000
BFGS:   13 16:21:10       -1.742871         0.000000
Minimization converged after 13 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 9.63155036711823e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Rb', 'Rb']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[5.644781560036107, -2.68992418007204e-34, -2.700900166485993e-34], [-2.820330011303605e-34, 5.644781560036109, 2.30056571805357e-18], [-4.38485999971974e-33, 2.3192411124971468e-18, 5.6447815400455195]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 2.80565070e-12  2.80565070e-12 -9.63155037e-12  3.31997913e-27
  9.66120386e-45 -2.90210786e-60]
energy per atom =  -0.8714356719248817
===============================================
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.