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:
MEAM_LAMMPS_AlmyrasSangiovanniSarakinos_2019_NAlTi__MO_958395190627_002
==== 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 18:19:33       15.957984        1.9401
BFGS:    1 18:19:33       15.541449        1.8074
BFGS:    2 18:19:33       14.878168        1.4957
BFGS:    3 18:19:33       14.352563        1.1211
BFGS:    4 18:19:33       13.980847        0.7142
BFGS:    5 18:19:33       13.769643        0.3886
BFGS:    6 18:19:33       13.716480        0.3579
BFGS:    7 18:19:33       13.710852        0.3379
BFGS:    8 18:19:33       13.672610        0.1689
BFGS:    9 18:19:33       13.658568        0.0153
BFGS:   10 18:19:33       13.658449        0.0008
BFGS:   11 18:19:33       13.658448        0.0000
BFGS:   12 18:19:33       13.658448        0.0000
BFGS:   13 18:19:33       13.658448        0.0000
Minimization converged after 13 steps.
Maximum force component: 1.2913374165847064e-09 eV/Angstrom
Maximum stress component: 9.868276253004796e-10 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([3.8654680460118946, 3.8654680460118946, 3.8654680460118946])
forces =  [[-1.29133742e-09 -1.29133742e-09 -1.29133742e-09]
 [ 1.29133742e-09  1.29133742e-09 -1.29133742e-09]
 [ 1.29133742e-09 -1.29133742e-09  1.29133742e-09]
 [-1.29133742e-09  1.29133742e-09  1.29133742e-09]
 [-1.29133742e-09 -1.29133742e-09 -1.29133742e-09]
 [ 1.29133742e-09  1.29133742e-09 -1.29133742e-09]
 [ 1.29133742e-09 -1.29133742e-09  1.29133742e-09]
 [-1.29133742e-09  1.29133742e-09  1.29133742e-09]]
stress =  [9.86827625e-10 9.86827625e-10 9.86827625e-10 0.00000000e+00
 0.00000000e+00 0.00000000e+00]
energy per atom =  1.7073060129364697
===============================================
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.