element(s):
['Co', 'Mn']
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:
['3.1285']
model name:
MEAM_LAMMPS_ChoiKimSeol_2017_CoMn__MO_808662295149_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Co', 'Mn']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  221
cell =  [[3.1285, 0, 0], [0, 3.1285, 0], [0, 0, 3.1285]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 12:27:47       -6.612794         2.443082
BFGS:    1 12:27:47       -6.857171         2.211694
BFGS:    2 12:27:47       -7.155356         1.732434
BFGS:    3 12:27:47       -7.366172         1.038246
BFGS:    4 12:27:47       -7.453268         0.072416
BFGS:    5 12:27:47       -7.453605         0.012787
BFGS:    6 12:27:47       -7.453616         0.000123
BFGS:    7 12:27:47       -7.453616         0.000000
BFGS:    8 12:27:47       -7.453616         0.000000
Minimization converged after 8 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.66092436087363e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Mn']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.834275848821627, 1.1805373879775067e-33, 1.606783293830398e-33], [1.0822382684362329e-32, 2.834275848821627, 1.338466454040937e-17], [-1.2177772055427092e-33, 1.3384664540409371e-17, 2.834275848821627]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.66092436e-13 -2.66092436e-13 -2.66092436e-13  1.98384268e-31
 -3.19664928e-35 -2.99858446e-52]
energy per atom =  -3.726807987438377
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0