element(s):
['N']
AFLOW prototype label:
A_cI8_199_a
Parameter names:
['a', 'x1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.8018', '0.66473467']
model name:
Tersoff_LAMMPS_KinaciHaskinsSevik_2012_BNC__MO_105008013807_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['N']
representative atom coordinates =  [[0.16473467 0.16473467 0.16473467]]
spacegroup =  199
cell =  [[3.8018, 0, 0], [0, 3.8018, 0], [0, 0, 3.8018]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 18:20:15       -8.318282        0.9594
BFGS:    1 18:20:15       -8.459943        0.9535
BFGS:    2 18:20:15       -8.935637        0.9818
BFGS:    3 18:20:15       -9.342179        1.0056
BFGS:    4 18:20:15       -9.680654        1.0256
BFGS:    5 18:20:15       -9.956707        1.0427
BFGS:    6 18:20:15      -10.179214        1.0577
BFGS:    7 18:20:15      -10.358790        1.0712
BFGS:    8 18:20:15      -10.506376        1.0837
BFGS:    9 18:20:15      -10.632042        1.0956
BFGS:   10 18:20:15      -10.744136        1.1071
BFGS:   11 18:20:15      -10.848913        1.1186
BFGS:   12 18:20:15      -10.950630        1.1300
BFGS:   13 18:20:15      -11.051949        1.1415
BFGS:   14 18:20:15      -11.154410        1.1531
BFGS:   15 18:20:15      -11.258836        1.1649
BFGS:   16 18:20:15      -11.365610        1.1768
BFGS:   17 18:20:15      -11.474861        1.1888
BFGS:   18 18:20:15      -11.579250        0.8395
BFGS:   19 18:20:15      -11.593488        0.4252
BFGS:   20 18:20:15      -11.655121        0.5207
BFGS:   21 18:20:15      -11.761028        0.8121
BFGS:   22 18:20:15      -11.856444        1.1317
BFGS:   23 18:20:15      -11.965881        0.8261
BFGS:   24 18:20:15      -12.026059        0.0679
BFGS:   25 18:20:15      -12.031812        0.0595
BFGS:   26 18:20:15      -12.032114        0.0011
BFGS:   27 18:20:15      -12.032115        0.0003
BFGS:   28 18:20:15      -12.032115        0.0000
BFGS:   29 18:20:15      -12.032115        0.0000
BFGS:   30 18:20:15      -12.032115        0.0000
Minimization converged after 30 steps.
Maximum force component: 5.582345157022628e-12 eV/Angstrom
Maximum stress component: 7.188088766510762e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['N', 'N', 'N', 'N', 'N', 'N', 'N', 'N']
basis =  [[0.125 0.125 0.125]
 [0.375 0.875 0.625]
 [0.875 0.625 0.375]
 [0.625 0.375 0.875]
 [0.625 0.625 0.625]
 [0.875 0.375 0.125]
 [0.375 0.125 0.875]
 [0.125 0.875 0.375]]
cellpar =  Cell([3.4090230456327513, 3.4090230456327513, 3.4090230456327513])
forces =  [[-5.58234516e-12 -5.58234516e-12 -5.58234516e-12]
 [ 5.58234516e-12  5.58234516e-12 -5.58234516e-12]
 [ 5.58234516e-12 -5.58234516e-12  5.58234516e-12]
 [-5.58234516e-12  5.58234516e-12  5.58234516e-12]
 [-5.58234516e-12 -5.58234516e-12 -5.58234516e-12]
 [ 5.58234516e-12  5.58234516e-12 -5.58234516e-12]
 [ 5.58234516e-12 -5.58234516e-12  5.58234516e-12]
 [-5.58234516e-12  5.58234516e-12  5.58234516e-12]]
stress =  [-7.18808877e-14 -7.18808877e-14 -7.18808877e-14  0.00000000e+00
  0.00000000e+00  0.00000000e+00]
energy per atom =  -1.5040144225850531
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Prototype label changed during relaxation: test template prototype is A_cI8_199_a, while relaxed is A_cI8_214_a. Skipping parameter set 0.
No parameter sets in this group successfully added a property instance. Skipping this group.