element(s):
['Co', 'Cr']
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:
['3.1963']
model name:
MEAM_LAMMPS_ChoiKimSeol_2017_CoCr__MO_410167849923_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Co', 'Cr']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  221
cell =  [[3.1963, 0, 0], [0, 3.1963, 0], [0, 0, 3.1963]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:48:33       -6.995851        2.9321
BFGS:    1 14:48:33       -7.353809        2.7492
BFGS:    2 14:48:33       -7.741357        2.3892
BFGS:    3 14:48:33       -8.060673        1.8308
BFGS:    4 14:48:33       -8.277810        1.0161
BFGS:    5 14:48:33       -8.349077        0.1278
BFGS:    6 14:48:33       -8.349979        0.0192
BFGS:    7 14:48:33       -8.350000        0.0003
BFGS:    8 14:48:33       -8.350000        0.0000
BFGS:    9 14:48:33       -8.350000        0.0000
Minimization converged after 9 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.5075366360667934e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Cr']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.8174692804790373, 8.299079901292346e-33, 6.238567007305448e-34], [6.829490611504269e-33, 2.8174692804790373, 2.630871042630185e-18], [-8.604734010834791e-34, 2.630871042630187e-18, 2.817469280479037]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [2.50753664e-12 2.50753664e-12 2.50753664e-12 2.00965170e-29
 3.39664487e-34 3.32205494e-51]
energy per atom =  -4.175000008971034
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0