element(s):
['Li']
AFLOW prototype label:
A_hP1_191_a
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.9353', '0.92505025']
model name:
Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Li']
representative atom coordinates =  [[0 0 0]]
spacegroup =  191
cell =  [[2.9353, 0, 0], [-1.46765, 2.5420443677285, 0], [0, 0, 2.7153]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:38:10       -1.577039        0.0946
BFGS:    1 14:38:10       -1.577206        0.0869
BFGS:    2 14:38:10       -1.578261        0.0122
BFGS:    3 14:38:10       -1.578270        0.0095
BFGS:    4 14:38:10       -1.578275        0.0089
BFGS:    5 14:38:11       -1.578283        0.0071
BFGS:    6 14:38:11       -1.578287        0.0030
BFGS:    7 14:38:11       -1.578288        0.0004
BFGS:    8 14:38:11       -1.578288        0.0001
BFGS:    9 14:38:11       -1.578288        0.0000
BFGS:   10 14:38:11       -1.578288        0.0000
BFGS:   11 14:38:11       -1.578288        0.0000
Minimization converged after 11 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 9.75586893340808e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Li']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[2.9651239245629184, 2.1615298339062612e-18, -5.9010062505956665e-36], [-1.4825619622814592, 2.567872644040501, 5.9011434955692444e-36], [-6.437935816361746e-38, 4.8981642885124054e-36, 2.765314550854705]])
forces =  [[0. 0. 0.]]
stress =  [-5.96904150e-11 -5.96904150e-11 -9.75586893e-11 -4.48081654e-46
 -4.26223362e-46 -2.79377314e-26]
energy per atom =  -1.578287957621686
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0