element(s):
['K']
AFLOW prototype label:
A_cP1_221_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.2844']
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 =  221
cell =  [[4.2844, 0, 0], [0, 4.2844, 0], [0, 0, 4.2844]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:16:20       -0.820986        0.0404
BFGS:    1 14:16:20       -0.821054        0.0384
BFGS:    2 14:16:20       -0.821725        0.0052
BFGS:    3 14:16:20       -0.821735        0.0014
BFGS:    4 14:16:20       -0.821735        0.0000
BFGS:    5 14:16:20       -0.821735        0.0000
BFGS:    6 14:16:20       -0.821735        0.0000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.6024797047482607e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['K']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[4.228144934792654, 2.912168882853528e-33, -1.8968159727061322e-33], [1.947641783413698e-33, 4.228144934792654, -2.195169208438963e-21], [-2.262141946285323e-33, -2.1951692084360004e-21, 4.228144934792654]])
forces =  [[0. 0. 0.]]
stress =  [-1.60247970e-15 -1.60247970e-15 -1.60247970e-15  3.60086987e-31
  2.24439616e-37 -6.99121264e-53]
energy per atom =  -0.821735486693371
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0