element(s):
['Cr']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.8741']
model name:
MEAM_LAMMPS_WuLeeSu_2017_NiCr__MO_880803040302_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cr']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[2.8741, 0, 0], [0, 2.8741, 0], [0, 0, 2.8741]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:53:30       -8.199264         0.103120
BFGS:    1 16:53:31       -8.199649         0.071002
BFGS:    2 16:53:31       -8.200000         0.001195
BFGS:    3 16:53:31       -8.200000         0.000014
BFGS:    4 16:53:31       -8.200000         0.000000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.970672916984868e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cr', 'Cr']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.880978012456989, -1.8683532265793e-33, 1.1532534541494944e-35], [1.7547898963711727e-34, 2.880978012456989, 2.1119300349726193e-20], [2.425572480161391e-34, 2.111930034972459e-20, 2.880978012456989]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.97067292e-10 -1.97067292e-10 -1.97067292e-10 -1.17418580e-27
 -2.47508046e-34 -2.20807520e-51]
energy per atom =  -4.100000003014754
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0