SYSTEM = si-thermal-static
ENCUT = 550
PREC = Accurate
EDIFF = 1E-6
NSW = 20
IBRION = 0
ISMEAR = 0
SIGMA = 0.05
ISYM = 0
LREAL = .FALSE.
LASPH = .TRUE.
LWAVE = .FALSE.
LCHARG = .FALSE.
NELM = 150
ALGO = Normal
NBANDS = 48

ISTART = 0
ICHARG = 2
ML_LMLFF = .TRUE.
ML_MODE = train
ML_CTIFOR = .005
ML_MB = 256
ML_MCONF = 128
ML_MCONF_NEW = 8
TEBEG = 600
TEEND = 600
POTIM = 1
MDALGO = 2
SMASS = 0

ML_ICRITERIA = 0
ML_CDOUB = 1.0
ML_NMDINT = 1
RANDOM_SEED = 77123 0 0
ISIF = 2
