element(s):
['N']
AFLOW prototype label:
A_tP4_136_f
Parameter names:
['a', 'c/a', 'x1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.2482', '1.3389436', '0.092623864']
model name:
Sim_LAMMPS_MEAM_AlmyrasSangiovanniSarakinos_2019_NAlTi__SM_871795249052_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['N']
representative atom coordinates =  [[0.09262386 0.09262386 0.        ]]
spacegroup =  136
cell =  [[4.2482, 0, 0], [0, 4.2482, 0], [0, 0, 5.6881]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 09:57:24      -16.522048         3.191724
BFGS:    1 09:57:24      -15.638895        16.641634
BFGS:    2 09:57:24      -16.775521         1.751687
BFGS:    3 09:57:24      -16.945216         1.599640
BFGS:    4 09:57:24      -17.168149         1.465357
BFGS:    5 09:57:24      -17.372714         1.361269
BFGS:    6 09:57:24      -17.559883         1.269298
BFGS:    7 09:57:24      -17.730997         1.184076
BFGS:    8 09:57:24      -17.887403         1.104078
BFGS:    9 09:57:24      -18.030356         1.028844
BFGS:   10 09:57:24      -18.161005         0.958165
BFGS:   11 09:57:24      -18.280398         0.891868
BFGS:   12 09:57:24      -18.389494         0.829772
BFGS:   13 09:57:24      -18.489166         0.771681
BFGS:   14 09:57:24      -18.580217         0.717394
BFGS:   15 09:57:24      -18.663379         0.666704
BFGS:   16 09:57:24      -18.739322         0.619407
BFGS:   17 09:57:24      -18.808663         0.575303
BFGS:   18 09:57:24      -18.871962         0.534199
BFGS:   19 09:57:24      -18.929736         0.495909
BFGS:   20 09:57:24      -18.982458         0.460258
BFGS:   21 09:57:24      -19.030558         0.427076
BFGS:   22 09:57:24      -19.074434         0.396205
BFGS:   23 09:57:24      -19.114502         0.371276
BFGS:   24 09:57:24      -19.152021         0.371671
BFGS:   25 09:57:24      -19.189796         0.386359
BFGS:   26 09:57:24      -19.232707         0.408989
BFGS:   27 09:57:24      -19.287027         0.497816
BFGS:   28 09:57:24      -19.355997         0.607178
BFGS:   29 09:57:24      -19.433093         0.649771
BFGS:   30 09:57:24      -19.492735         0.551381
BFGS:   31 09:57:24      -19.519603         0.113508
BFGS:   32 09:57:24      -19.520000         0.003345
BFGS:   33 09:57:24      -19.520000         0.000834
BFGS:   34 09:57:24      -19.520000         0.000000
BFGS:   35 09:57:24      -19.520000         0.000000
Minimization converged after 35 steps.
Maximum force component: 1.5454304502782182e-13 eV/Angstrom
Maximum stress component: 9.63567730994879e-16 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['N', 'N', 'N', 'N']
basis =  [[0.06679498 0.06679498 0.        ]
 [0.93320502 0.93320502 0.        ]
 [0.43320502 0.56679498 0.5       ]
 [0.56679498 0.43320502 0.5       ]]
cellpar =  Cell([[5.822424081649435, 1.4421869819290704e-34, 1.5653271255486638e-33], [1.5209983169452963e-34, 5.822424081649435, 5.580669708027351e-17], [1.4948746970084865e-32, 7.188163322453382e-17, 7.359819294829057]])
forces =  [[-1.54543045e-13 -1.54543045e-13 -1.48126223e-30]
 [ 1.54543045e-13  1.54543045e-13  1.48126223e-30]
 [ 1.54543045e-13 -1.54543045e-13 -1.48126223e-30]
 [-1.54543045e-13  1.54543045e-13  1.48126223e-30]]
stress =  [ 9.63567731e-16  9.63567731e-16  2.31662945e-47  1.51670646e-31
 -1.95713096e-48  2.17103981e-64]
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