element(s):
['Al', 'Co']
AFLOW prototype label:
AB_cP2_221_a_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
2
Parameter values for parameter set 0:
['2.9525']
Parameter values for parameter set 1:
['2.8121']
model name:
MEAM_LAMMPS_DongKimKo_2012_CoAl__MO_099716416216_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Co']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  221
cell =  [[2.9525, 0, 0], [0, 2.9525, 0], [0, 0, 2.9525]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:55:50       -8.800399         1.000368
BFGS:    1 15:55:50       -8.839108         0.802659
BFGS:    2 15:55:50       -8.899926         0.030511
BFGS:    3 15:55:50       -8.899998         0.004239
BFGS:    4 15:55:50       -8.900000         0.000018
BFGS:    5 15:55:50       -8.900000         0.000000
BFGS:    6 15:55:50       -8.900000         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.1165512577336984e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Co']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.8599623049331506, -1.6539093461141836e-32, 1.431083507688368e-33], [1.4376928970750186e-33, 2.8599623049331506, -4.2254120942878595e-19], [1.1025476301018751e-32, -4.225412094287966e-19, 2.8599623049331506]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 3.11655126e-15  3.11655126e-15  3.11655126e-15 -3.54667548e-31
  1.25579455e-34  6.37449138e-52]
energy per atom =  -4.449999919971931
===============================================
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Co']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  221
cell =  [[2.8121, 0, 0], [0, 2.8121, 0], [0, 0, 2.8121]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:55:52       -8.868377         0.637661
BFGS:    1 15:55:52       -8.883304         0.456119
BFGS:    2 15:55:52       -8.899892         0.035239
BFGS:    3 15:55:52       -8.899999         0.002186
BFGS:    4 15:55:52       -8.900000         0.000011
BFGS:    5 15:55:52       -8.900000         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.28695925079685e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Co']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.8599623046232674, -5.74343092941317e-33, 7.253361631524661e-33], [-2.874591861393104e-33, 2.8599623046232674, 1.9809959834729638e-19], [-1.0878912322488734e-32, 1.980995983473057e-19, 2.8599623046232674]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-3.28695925e-10 -3.28695925e-10 -3.28695925e-10 -1.87821313e-26
 -2.00927129e-33 -2.63623424e-49]
energy per atom =  -4.449999919971927
===============================================
Parameter sets [0, 1] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0