element(s):
['F', 'Li']
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:
['2.5617']
model name:
Sim_LAMMPS_EIM_Zhou_2010_BrClCsFIKLiNaRb__SM_259779394709_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['F', 'Li']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  221
cell =  [[2.5617, 0, 0], [0, 2.5617, 0], [0, 0, 2.5617]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 12:05:55       -7.455041         1.341974
BFGS:    1 12:05:55       -7.526542         1.138494
BFGS:    2 12:05:55       -7.654818         0.588602
BFGS:    3 12:05:55       -7.683555         0.314781
BFGS:    4 12:05:55       -7.689550         0.073810
BFGS:    5 12:05:55       -7.689944         0.005226
BFGS:    6 12:05:55       -7.689946         0.000095
BFGS:    7 12:05:55       -7.689946         0.000000
BFGS:    8 12:05:55       -7.689946         0.000000
Minimization converged after 8 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.6618849390383264e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['F', 'Li']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.4268192972286773, 3.953995979488615e-33, -1.1520448074085699e-32], [1.725303031286898e-32, 2.4268192972286773, 1.4683706087676955e-18], [9.007465470710514e-33, 1.4683706087676928e-18, 2.4268192972286764]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [3.66188494e-13 3.66188494e-13 3.66188494e-13 4.29138450e-29
 2.79051471e-33 2.75933144e-49]
energy per atom =  -3.8449729185698684
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0