element(s):
['Al', 'Ni']
AFLOW prototype label:
AB_cP2_221_a_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.8655']
model name:
EAM_Dynamo_MishinMehlPapaconstantopoulos_2002_NiAl__MO_109933561507_005
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Ni']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  221
cell =  [[2.8655, 0, 0], [0, 2.8655, 0], [0, 0, 2.8655]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 12:20:50       -8.929901         0.082903
BFGS:    1 12:20:50       -8.930159         0.062420
BFGS:    2 12:20:50       -8.930495         0.000522
BFGS:    3 12:20:50       -8.930495         0.000003
BFGS:    4 12:20:50       -8.930495         0.000000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.3489345750233328e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Ni']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.8586747053602015, 3.5926717136687995e-34, 3.361123002272551e-33], [9.003844231498867e-33, 2.8586747053602015, 4.786204405527696e-21], [-2.801726026084863e-33, 4.786204405532988e-21, 2.8586747053602015]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.34893458e-11  1.34893458e-11  1.34893458e-11 -7.81504626e-29
  3.14231519e-35 -3.69111980e-52]
energy per atom =  -4.4652474624885885
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0