element(s):
['K']
AFLOW prototype label:
A_tI4_141_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:
['4.3232', '3.6688101']
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 =  141
cell =  [[4.3232, 0, 0], [0, 4.3232, 0], [0, 0, 15.861]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:12:19       -3.452464        0.0041
BFGS:    1 17:12:19       -3.452464        0.0041
BFGS:    2 17:12:19       -3.452486        0.0011
BFGS:    3 17:12:19       -3.452487        0.0009
BFGS:    4 17:12:19       -3.452487        0.0007
BFGS:    5 17:12:20       -3.452487        0.0007
BFGS:    6 17:12:20       -3.452487        0.0005
BFGS:    7 17:12:20       -3.452487        0.0004
BFGS:    8 17:12:20       -3.452487        0.0002
BFGS:    9 17:12:20       -3.452488        0.0001
BFGS:   10 17:12:20       -3.452488        0.0000
BFGS:   11 17:12:20       -3.452488        0.0000
BFGS:   12 17:12:20       -3.452488        0.0000
BFGS:   13 17:12:20       -3.452488        0.0000
Minimization converged after 13 steps.
Maximum force component: 5.041873096895735e-33 eV/Angstrom
Maximum stress component: 1.5425019848648802e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['K', 'K', 'K', 'K']
basis =  [[0.00000000e+00 0.00000000e+00 1.42378905e-32]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [1.09216654e-33 5.00000000e-01 2.50000000e-01]
 [5.00000000e-01 1.11501529e-35 7.50000000e-01]]
cellpar =  Cell([[4.318169376023586, 4.698161310987806e-39, -1.0929183273118836e-44], [7.85239179339132e-39, 4.318169376023586, 3.4210213240685745e-20], [6.805050654591883e-40, 1.2545375604534734e-19, 15.84392355748202]])
forces =  [[ 2.91077210e-33  1.66329834e-33  1.31772948e-53]
 [-1.66329834e-33 -8.31649171e-34  2.28857151e-33]
 [-8.31649171e-34 -5.04187310e-33 -3.99436749e-53]
 [ 1.66329834e-33 -1.66329834e-33 -1.31772948e-53]]
stress =  [-9.83911929e-12 -9.83911929e-12 -1.54250198e-11 -2.46264136e-29
 -8.49649328e-51 -6.87970177e-67]
energy per atom =  -0.8631218775491056
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0