#Basic parameters
ISMEAR = 0
SIGMA = 0.1
LREAL = Auto
ISYM = -1
NELM = 100
EDIFF = 1E-4
LWAVE = .FALSE.
LCHARG = .FALSE.

#Parallelization of ab initio calculations
NCORE = 2

#MD
IBRION = 0
MDALGO = 2
ISIF = 2
SMASS = 1.0
TEBEG = 2000
NSW = 10000
POTIM = 3.0
RANDOM_SEED =          88951986                0                0

#Machine learning paramters
ML_LMLFF = .TRUE.
ML_ISTART = 0
