element(s):
['Ni']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.5048']
model name:
Sim_LAMMPS_MEAM_MaiselKoZhang_2017_VNiTi__SM_971529344487_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ni']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[3.5048, 0, 0], [0, 3.5048, 0], [0, 0, 3.5048]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:11:33      -17.794846        0.1831
BFGS:    1 17:11:33      -17.796181        0.1572
BFGS:    2 17:11:33      -17.799997        0.0041
BFGS:    3 17:11:33      -17.800000        0.0001
BFGS:    4 17:11:33      -17.800000        0.0000
BFGS:    5 17:11:33      -17.800000        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 8.251464604300393e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.46922946e-35 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[3.521391741330055, 9.922472112152864e-33, -1.34904836458049e-32], [1.4283100984842466e-32, 3.521391741330055, -3.085289635009449e-18], [2.0970247451894656e-35, -3.0852896350094634e-18, 3.521391741330055]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-8.25146460e-14 -8.25146460e-14 -8.25146460e-14 -1.87734463e-29
 -5.17714762e-36 -8.20941608e-52]
energy per atom =  -4.450000000475031
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0