element(s):
['Rb']
AFLOW prototype label:
A_hP3_191_ad
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:
['7.9877', '0.60980007']
model name:
Morse_Shifted_GirifalcoWeizer_1959HighCutoff_Rb__MO_908110223949_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['Rb', 'Rb']
representative atom coordinates =  [[0.         0.         0.        ]
 [0.33333333 0.66666667 0.5       ]]
spacegroup =  191
cell =  [[7.9877, 0, 0], [-3.99385, 6.917551117809, 0], [0, 0, 4.8709]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 15:14:40       -2.645403        0.0504
BFGS:    1 15:14:40       -2.645442        0.0498
BFGS:    2 15:14:40       -2.647018        0.0063
BFGS:    3 15:14:40       -2.647051        0.0031
BFGS:    4 15:14:40       -2.647051        0.0031
BFGS:    5 15:14:40       -2.647052        0.0030
BFGS:    6 15:14:40       -2.647054        0.0026
BFGS:    7 15:14:40       -2.647057        0.0017
BFGS:    8 15:14:40       -2.647060        0.0012
BFGS:    9 15:14:40       -2.647061        0.0005
BFGS:   10 15:14:40       -2.647061        0.0001
BFGS:   11 15:14:40       -2.647061        0.0000
BFGS:   12 15:14:40       -2.647061        0.0000
BFGS:   13 15:14:40       -2.647061        0.0000
BFGS:   14 15:14:40       -2.647061        0.0000
Minimization converged after 14 steps.
Maximum force component: 5.66895539193802e-33 eV/Angstrom
Maximum stress component: 1.7413842073496797e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Rb', 'Rb', 'Rb']
basis =  [[0.         0.         0.        ]
 [0.33333333 0.66666667 0.5       ]
 [0.66666667 0.33333333 0.5       ]]
cellpar =  Cell([[8.027699801654688, 4.7251226857435365e-18, -4.875990389068841e-38], [-4.013849900827344, 6.952191962188255, -5.021638266134202e-38], [-8.55278425814935e-37, -2.335781047964062e-37, 4.776518117344215]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [-5.66895539e-33  2.67788694e-33  5.69952872e-72]
 [ 2.06143832e-33 -3.57051591e-33  2.57901960e-71]]
stress =  [-9.60212888e-13 -9.60212888e-13 -1.74138421e-12  1.76392612e-49
 -9.86690716e-50  9.87259969e-29]
energy per atom =  -0.882353735876
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0