NDOWN (.param)
Keyword type
Real
Description
This keyword determines the total number of down-spin electrons.
This parameter is used only if SPIN_POLARIZED = TRUE.
Default
If the SPIN has been specified then:
NDOWN : (NELECTRONS - SPIN)/2
If neither NDOWN nor SPIN have been specified:
NDOWN : NELECTRONS/2
Example
NDOWN : 12
See Also:
SPIN
SPIN_POLARIZED
NELECTRONS
NUP
CASTEP keyword glossary
CASTEP parameters keywords