Next:
Introduction: HF functional
Up:
The INCAR File
Previous:
On site Coulomb interaction:
Contents
HF type calculations
Available only in VASP.5.X.
Subsections
Introduction: HF functional
LHFCALC
Amount of exact/DFT exchange and correlation :
AEXX
,
AGGAX
,
AGGAC
and
ALDAC
ENCUTFOCK
: FFT grid in the HF related routines
LMAXFOCK
(or old
HFLMAXF
)
LMAXFOCKAE
HFSCREEN
and
LTHOMAS
NKRED
,
NKREDX
,
NKREDY
,
NKREDZ
and
EVENONLY
,
ODDONLY
When
NKRED
should not be applied
Typical HF type calculations
Georg Kresse
2009-04-23
