element(s):
['Na']
AFLOW prototype label:
A_hP4_194_ac
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:
['4.463', '1.4525207']
model name:
MEAM_LAMMPS_KimKoLee_2020_Na__MO_321355778754_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Na', 'Na']
representative atom coordinates =  [[0.         0.         0.        ]
 [0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[4.463, 0, 0], [-2.2315, 3.8650713770899, 0], [0, 0, 6.4826]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 15:20:52       -3.002080        1.0067
BFGS:    1 15:20:52       -3.042818        0.9679
BFGS:    2 15:20:52       -3.173837        0.8393
BFGS:    3 15:20:52       -3.289012        0.7313
BFGS:    4 15:20:52       -3.389451        0.6384
BFGS:    5 15:20:52       -3.476204        0.5524
BFGS:    6 15:20:52       -3.544492        0.4059
BFGS:    7 15:20:52       -3.568025        0.4597
BFGS:    8 15:20:52       -3.620893        0.3905
BFGS:    9 15:20:52       -3.663647        0.3269
BFGS:   10 15:20:52       -3.697243        0.2686
BFGS:   11 15:20:52       -3.722576        0.2152
BFGS:   12 15:20:52       -3.740474        0.1651
BFGS:   13 15:20:52       -3.731793        0.9505
BFGS:   14 15:20:52       -3.744202        0.1450
BFGS:   15 15:20:52       -3.746184        0.1321
BFGS:   16 15:20:52       -3.749162        0.5717
BFGS:   17 15:20:52       -3.753102        0.3178
BFGS:   18 15:20:52       -3.759159        0.2267
BFGS:   19 15:20:52       -3.776209        0.1250
BFGS:   20 15:20:52       -3.790143        0.0977
BFGS:   21 15:20:52       -3.801959        0.0915
BFGS:   22 15:20:52       -3.811830        0.0888
BFGS:   23 15:20:52       -3.819683        0.0825
BFGS:   24 15:20:52       -3.825365        0.0719
BFGS:   25 15:20:52       -3.828699        0.0564
BFGS:   26 15:20:52       -3.829564        0.0395
BFGS:   27 15:20:52       -3.829664        0.0383
BFGS:   28 15:20:52       -3.830979        0.0016
BFGS:   29 15:20:52       -3.830981        0.0001
BFGS:   30 15:20:52       -3.830981        0.0000
BFGS:   31 15:20:52       -3.830981        0.0000
BFGS:   32 15:20:52       -3.830981        0.0000
Minimization converged after 32 steps.
Maximum force component: 8.922062300741172e-33 eV/Angstrom
Maximum stress component: 7.453968038822018e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Na', 'Na', 'Na', 'Na']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [2.24291222e-52 2.08187837e-52 5.00000000e-01]
 [3.33333333e-01 6.66666667e-01 2.50000000e-01]
 [6.66666667e-01 3.33333333e-01 7.50000000e-01]]
cellpar =  Cell([[5.5591195266948485, 4.044893013854881e-18, 4.621213907909457e-37], [-2.7795597633474243, 4.814338732791864, -5.0596127096075135e-37], [9.557592867804651e-37, -2.034377269050695e-36, 6.676846405652488]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [-8.92206230e-33  5.56324748e-33 -2.90850892e-53]
 [ 3.56882492e-34 -6.18138609e-34  6.49630642e-71]]
stress =  [ 3.05234404e-12  3.05234404e-12  7.45396804e-12 -3.99430475e-36
 -5.59348897e-48 -7.94073689e-28]
energy per atom =  -0.9577453047353992
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0