element(s):
['Al', 'Ni']
AFLOW prototype label:
AB3_cP4_221_a_c
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.5446']
model name:
MEAM_LAMMPS_CostaAgrenClavaguera_2007_AlNi__MO_131642768288_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Ni']
representative atom coordinates =  [[0.  0.  0. ]
 [0.  0.5 0.5]]
spacegroup =  221
cell =  [[3.5446, 0, 0], [0, 3.5446, 0], [0, 0, 3.5446]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 20:40:36      -18.443198         0.284649
BFGS:    1 20:40:36      -18.446414         0.242778
BFGS:    2 20:40:36      -18.455236         0.009274
BFGS:    3 20:40:36      -18.455250         0.000320
BFGS:    4 20:40:37      -18.455250         0.000000
BFGS:    5 20:40:37      -18.455250         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.8589749301267714e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Ni', 'Ni', 'Ni']
basis =  [[0.  0.  0. ]
 [0.  0.5 0.5]
 [0.5 0.  0.5]
 [0.5 0.5 0. ]]
cellpar =  Cell([[3.569956264316206, 9.207954670823412e-33, -1.8199541444784344e-33], [1.0934962011092128e-32, 3.569956264316206, -3.966483960390505e-20], [-2.459908807899768e-34, -3.9664839603907354e-20, 3.569956264316206]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.85897493e-12 -1.85897493e-12 -1.85897493e-12  3.21741718e-29
 -7.04215307e-62  1.71393623e-60]
energy per atom =  -4.613812444600888
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0