SYSTEM=Si2-VTST-IOPT8
ENCUT=450
PREC=Accurate
EDIFF=1E-6
EDIFFG=-0.02
ISPIN=1
ISMEAR=0
SIGMA=0.05
NBANDS=16
LREAL=.FALSE.
LASPH=.TRUE.
ISYM=0
ISIF=2
IBRION=3
POTIM=0
IOPT=8
NSW=160
NELM=150
ALGO=Normal
MAXMOVE=0.10
TIMESTEP=0.20
SDALPHA=0.10
FDSTEP=0.005
LWAVE=.FALSE.
LCHARG=.FALSE.
PYAMFF_MAXEPOCH=500
PYAMFF_MAXITER=15
PYAMFF_SWFTOL=0.05
PYAMFF_MODEL=mlff.pyamff
