element(s):
['Al', 'N']
AFLOW prototype label:
AB_hP4_186_b_b
Parameter names:
['a', 'c/a', 'z1', 'z2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.1301', '1.6009073', '0.50007771', '0.88202229']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'N']
representative atom coordinates =  [[0.33333333 0.66666667 0.50007771]
 [0.33333333 0.66666667 0.88202229]]
spacegroup =  186
cell =  [[3.1301, 0, 0], [-1.56505, 2.7107461163857, 0], [0, 0, 5.011]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 11:53:29      -64.624082        11.026076
BFGS:    1 11:53:29      -65.689218         7.429505
BFGS:    2 11:53:29      -66.266642         8.723174
BFGS:    3 11:53:29      -66.633893         3.910338
BFGS:    4 11:53:29      -66.807224         1.895375
BFGS:    5 11:53:29      -66.991154         3.932597
BFGS:    6 11:53:29      -67.145777         7.049034
BFGS:    7 11:53:29      -67.364969         5.158401
BFGS:    8 11:53:29      -67.688654         6.953705
BFGS:    9 11:53:29      -68.472007         7.335089
BFGS:   10 11:53:30      -69.310517         9.387842
BFGS:   11 11:53:30      -70.181536        11.032584
BFGS:   12 11:53:30      -71.168951        12.695186
BFGS:   13 11:53:30      -72.286881        14.378804
BFGS:   14 11:53:30      -73.542525        16.136251
BFGS:   15 11:53:30      -74.937639        17.710175
BFGS:   16 11:53:30      -76.467002        19.089589
BFGS:   17 11:53:30      -78.102356        20.061556
BFGS:   18 11:53:30      -79.787875        20.191216
BFGS:   19 11:53:30      -81.417620        18.824302
BFGS:   20 11:53:30      -82.851756        14.884972
BFGS:   21 11:53:31      -83.782914         6.833545
BFGS:   22 11:53:31      -83.879033         2.839525
BFGS:   23 11:53:31      -83.923296         0.951035
BFGS:   24 11:53:31      -83.924557         0.215310
BFGS:   25 11:53:31      -83.924934         0.066858
BFGS:   26 11:53:31      -83.924973         0.010658
BFGS:   27 11:53:31      -83.924974         0.000785
BFGS:   28 11:53:31      -83.924974         0.000034
BFGS:   29 11:53:32      -83.924974         0.000000
BFGS:   30 11:53:32      -83.924974         0.000000
Minimization converged after 30 steps.
Maximum force component: 7.57712755809336e-09 eV/Angstrom
Maximum stress component: 4.992373693721124e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'N', 'N']
basis =  [[0.33333333 0.66666667 0.44105   ]
 [0.66666666 0.33333334 0.94105   ]
 [0.33333333 0.66666667 0.94105   ]
 [0.66666666 0.33333334 0.44105   ]]
cellpar =  Cell([[3.199970324040623, 2.176801792385951e-17, -4.0775186943325726e-35], [-1.5999851620203116, 2.7712555919755015, -4.275652032993499e-35], [-4.1191450395040005e-36, 2.6979570237056046e-35, 3.722565753568872]])
forces =  [[-8.41443829e-31  1.45742346e-30 -7.57712376e-09]
 [ 8.41443829e-30 -2.91484693e-30 -7.57712376e-09]
 [-5.89010680e-30 -1.45742346e-30  7.57712756e-09]
 [-5.89010680e-30 -1.45742346e-30  7.57712756e-09]]
stress =  [ 3.17351308e-10  3.17351308e-10  4.99237369e-10  1.63711173e-44
  9.23997423e-45 -1.12980561e-25]
energy per atom =  -20.9812435194578
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Prototype label changed during relaxation: test template prototype is AB_hP4_186_b_b, while relaxed is AB_hP4_194_c_d. Skipping parameter set 0.
No parameter sets in this group successfully added a property instance. Skipping this group.