element(s):
['K']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.6342']
model name:
Morse_Shifted_GirifalcoWeizer_1959MedCutoff_K__MO_202712315930_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['K']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[6.6342, 0, 0], [0, 6.6342, 0], [0, 0, 6.6342]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:22:08       -3.696077         0.031554
BFGS:    1 15:22:08       -3.696119         0.031114
BFGS:    2 15:22:08       -3.697572         0.001100
BFGS:    3 15:22:08       -3.697574         0.000036
BFGS:    4 15:22:08       -3.697574         0.000000
BFGS:    5 15:22:08       -3.697574         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.1044988374877285e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['K', 'K', 'K', 'K']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [4.15796635e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[6.582330957657718, -3.9404823425575807e-33, 1.6629715177346043e-32], [-1.8881385462159201e-32, 6.582330957657718, 8.206649047807052e-19], [-1.9730569130548643e-32, 8.206649047807451e-19, 6.582330957657718]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.10449884e-14 -2.10449884e-14 -2.10449884e-14 -7.62682224e-31
 -7.40849182e-36 -3.97209533e-52]
energy per atom =  -0.9243933789696359
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0