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 15:40:28      -64.624082       11.0261
BFGS:    1 15:40:28      -65.689218        7.4295
BFGS:    2 15:40:28      -66.266642        8.7232
BFGS:    3 15:40:28      -66.633893        3.9103
BFGS:    4 15:40:28      -66.807224        1.8954
BFGS:    5 15:40:28      -66.991154        3.9326
BFGS:    6 15:40:28      -67.145777        7.0490
BFGS:    7 15:40:28      -67.364969        5.1584
BFGS:    8 15:40:28      -67.688654        6.9537
BFGS:    9 15:40:28      -68.472007        7.3351
BFGS:   10 15:40:29      -69.310517        9.3878
BFGS:   11 15:40:29      -70.181536       11.0326
BFGS:   12 15:40:29      -71.168951       12.6952
BFGS:   13 15:40:29      -72.286881       14.3788
BFGS:   14 15:40:29      -73.542525       16.1363
BFGS:   15 15:40:29      -74.937639       17.7102
BFGS:   16 15:40:29      -76.467002       19.0896
BFGS:   17 15:40:29      -78.102356       20.0616
BFGS:   18 15:40:29      -79.787875       20.1912
BFGS:   19 15:40:29      -81.417620       18.8243
BFGS:   20 15:40:29      -82.851756       14.8850
BFGS:   21 15:40:29      -83.782914        6.8335
BFGS:   22 15:40:29      -83.879033        2.8395
BFGS:   23 15:40:29      -83.923296        0.9510
BFGS:   24 15:40:29      -83.924557        0.2153
BFGS:   25 15:40:29      -83.924934        0.0669
BFGS:   26 15:40:29      -83.924973        0.0107
BFGS:   27 15:40:29      -83.924974        0.0008
BFGS:   28 15:40:29      -83.924974        0.0000
BFGS:   29 15:40:29      -83.924974        0.0000
BFGS:   30 15:40:29      -83.924974        0.0000
Minimization converged after 30 steps.
Maximum force component: 7.577418264733975e-09 eV/Angstrom
Maximum stress component: 4.992597725543202e-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([[3.1999703240406245, 2.277472784919406e-17, -1.9917743350270377e-35], [-1.5999851620203123, 2.7712555919755024, -7.120955295147227e-35], [-4.880598521950572e-35, 6.163126989067087e-35, 3.722565753568873]])
forces =  [[-3.36577532e-30 -5.82969385e-30 -7.57741226e-09]
 [-3.36577532e-30 -5.82969385e-30 -7.57741226e-09]
 [-7.57299446e-30  1.45742346e-30  7.57741826e-09]
 [ 5.04866297e-30 -8.74454078e-30  7.57741826e-09]]
stress =  [ 3.17370438e-10  3.17370438e-10  4.99259773e-10 -3.68401999e-33
 -8.62285107e-34 -9.15829873e-26]
energy per atom =  -20.98124351945779
===============================================
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.