element(s):
['Rb']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.6544']
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 =  229
cell =  [[5.6544, 0, 0], [0, 5.6544, 0], [0, 0, 5.6544]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:22:01       -1.742841         0.005901
BFGS:    1 16:22:01       -1.742843         0.005755
BFGS:    2 16:22:01       -1.742871         0.000041
BFGS:    3 16:22:01       -1.742871         0.000000
BFGS:    4 16:22:01       -1.742871         0.000000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.4567560876541253e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Rb', 'Rb']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[5.644781553589246, 4.548286608252475e-33, -3.9015559660933e-34], [7.050404340207069e-33, 5.644781553589246, 1.876266800562398e-21], [4.576633426610269e-35, 1.8762668006616573e-21, 5.644781553589246]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.45675609e-13  1.45675609e-13  1.45675609e-13  1.95893916e-31
  3.27286086e-64 -4.07221282e-63]
energy per atom =  -0.8714356719248811
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0