SYSTEM = Cu44-custom-core
ENCUT = 550
PREC = Accurate
EDIFF = 1E-6
NELM = 240
ALGO = Normal
ISMEAR = 0
SIGMA = 0.05
LREAL = .FALSE.
LASPH = .TRUE.
LWAVE = .FALSE.
LCHARG = .FALSE.
ISYM = 0
NSW = 0
IBRION = -1
NCORE = 1
AMIX = 0.1
BMIX = 0.0001
NBANDS = 40
LSOL = .TRUE.
EB_K = 78.4
NC_K = 0.0025
SIGMA_K = 0.6
TAU = 0.000525
EDIFFSOL = 1E-8
LAMBDA_D_K = 3
NELECT = 44
CORE_C = 0.5
SIGMA_RC_K = 0.5
SIGMA_NC_K = 0.45
