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_1959LowCutoff_Rb__MO_754498969542_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 17:21:30       -1.553418         0.127108
BFGS:    1 17:21:30       -1.553858         0.123688
BFGS:    2 17:21:30       -1.561112         0.051750
BFGS:    3 17:21:30       -1.561775         0.025950
BFGS:    4 17:21:30       -1.561844         0.016170
BFGS:    5 17:21:30       -1.561867         0.015058
BFGS:    6 17:21:30       -1.561877         0.016123
BFGS:    7 17:21:30       -1.561945         0.019932
BFGS:    8 17:21:30       -1.562119         0.019800
BFGS:    9 17:21:30       -1.562527         0.024671
BFGS:   10 17:21:30       -1.562867         0.024953
BFGS:   11 17:21:30       -1.563126         0.018980
BFGS:   12 17:21:30       -1.563353         0.006899
BFGS:   13 17:21:30       -1.563388         0.001375
BFGS:   14 17:21:30       -1.563389         0.000201
BFGS:   15 17:21:30       -1.563389         0.000037
BFGS:   16 17:21:30       -1.563389         0.000005
BFGS:   17 17:21:30       -1.563389         0.000000
BFGS:   18 17:21:30       -1.563389         0.000000
Minimization converged after 18 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.7682580838803394e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Rb', 'Rb']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[5.791385688399794, -4.2646219067830174e-36, 2.501236553502035e-32], [6.458565375347828e-35, 5.791385688399792, 1.9084647621695537e-17], [-8.708652475429907e-33, 1.805205260519773e-17, 5.7913856517973175]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 3.76825808e-11  3.76825808e-11  7.92386120e-12  8.52479242e-28
  2.29686518e-35 -1.67764697e-51]
energy per atom =  -0.7816944835437252
===============================================
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.