element(s):
['N']
AFLOW prototype label:
A_hP4_194_f
Parameter names:
['a', 'c/a', 'z1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.2753', '1.6578954', '0.32853587']
model name:
Sim_LAMMPS_MEAM_AlmyrasSangiovanniSarakinos_2019_NAlTi__SM_871795249052_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['N']
representative atom coordinates =  [[0.33333333 0.66666667 0.32853587]]
spacegroup =  194
cell =  [[4.2753, 0, 0], [-2.13765, 3.7025184087996, 0], [0, 0, 7.088]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:35:56      -16.532264         3.866036
BFGS:    1 15:35:56      -15.426438        18.984751
BFGS:    2 15:35:56      -16.830941         2.550052
BFGS:    3 15:35:57      -17.015524         2.375520
BFGS:    4 15:35:57      -17.183656         2.024657
BFGS:    5 15:35:57      -17.335388         1.671819
BFGS:    6 15:35:57      -17.476529         1.378918
BFGS:    7 15:35:57      -17.609458         1.148073
BFGS:    8 15:35:57      -17.735280         1.104235
BFGS:    9 15:35:57      -17.854491         1.080706
BFGS:   10 15:35:57      -17.967315         1.047305
BFGS:   11 15:35:57      -18.073884         1.006967
BFGS:   12 15:35:57      -18.174315         0.962039
BFGS:   13 15:35:57      -18.268753         0.914354
BFGS:   14 15:35:57      -18.357380         0.865319
BFGS:   15 15:35:57      -18.440408         0.815993
BFGS:   16 15:35:57      -18.518086         0.767840
BFGS:   17 15:35:57      -18.591043         0.730961
BFGS:   18 15:35:57      -18.661126         0.719326
BFGS:   19 15:35:57      -18.731382         0.741209
BFGS:   20 15:35:57      -18.805903         0.793290
BFGS:   21 15:35:58      -18.888561         0.849248
BFGS:   22 15:35:58      -18.978504         0.839422
BFGS:   23 15:35:58      -19.063673         0.656498
BFGS:   24 15:35:58      -19.119961         0.660270
BFGS:   25 15:35:58      -19.153987         0.503267
BFGS:   26 15:35:58      -19.184615         0.466094
BFGS:   27 15:35:58      -19.212706         0.441871
BFGS:   28 15:35:58      -19.238481         0.419468
BFGS:   29 15:35:58      -19.262227         0.402607
BFGS:   30 15:35:58      -19.285538         0.419178
BFGS:   31 15:35:58      -19.312107         0.496872
BFGS:   32 15:35:58      -19.346393         0.629560
BFGS:   33 15:35:58      -19.391268         0.791826
BFGS:   34 15:35:58      -19.444798         0.894515
BFGS:   35 15:35:58      -19.495786         0.763665
BFGS:   36 15:35:59      -19.518737         0.684311
BFGS:   37 15:35:59      -19.519981         0.083008
BFGS:   38 15:35:59      -19.520000         0.000827
BFGS:   39 15:35:59      -19.520000         0.000001
BFGS:   40 15:35:59      -19.520000         0.000000
Minimization converged after 40 steps.
Maximum force component: 8.919087690628656e-12 eV/Angstrom
Maximum stress component: 7.361172862601902e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['N', 'N', 'N', 'N']
basis =  [[0.33333333 0.66666667 0.3039333 ]
 [0.66666666 0.33333334 0.8039333 ]
 [0.66666666 0.33333334 0.6960667 ]
 [0.33333333 0.66666667 0.1960667 ]]
cellpar =  Cell([[5.493888856434236, -1.9181709619492238e-17, -6.339416322460854e-36], [-2.746944428217118, 4.757847315240287, -1.232322463008089e-35], [-7.69750916453479e-36, -6.701784210550065e-35, 10.197780215754745]])
forces =  [[ 2.05362737e-44 -3.54995942e-44 -8.91908769e-12]
 [ 2.05362737e-44  8.89541363e-44 -8.91908769e-12]
 [-2.05362737e-44 -8.89541363e-44  8.91908769e-12]
 [-2.05362737e-44  3.54995942e-44  8.91908769e-12]]
stress =  [ 1.68497038e-44  1.68497038e-44  7.36117286e-14 -1.54109373e-45
  5.33321958e-46 -3.31665083e-60]
energy per atom =  -4.879999994596931
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0