HYB_GGA_XC_CAM_O3LYP

CAM-O3LYP [Edit on GitHub]

Keywords

• SECTION_PARAMETERS

• SCALE

• _B

• _C

• _CLR

• _CLYP

• _CSR

• _OMEGA

Keyword descriptions

SECTION_PARAMETERS: logical = F

Lone keyword: T

Activates the functional. [Edit on GitHub]

SCALE: real = 1.00000000E+000

Scales this functional [Edit on GitHub]

_B: real = 9.26200000E-001

fraction of LDA exchage [Edit on GitHub]

_C: real = 8.13300000E-001

fraction of OPTX gradient correction [Edit on GitHub]

_CLR: real = 8.00000000E-001

fraction of long-range HF exchange [Edit on GitHub]

_CLYP: real = 8.10000000E-001

fraction of LYP correlation [Edit on GitHub]

_CSR: real = 1.16100000E-001

fraction of short-range HF exchange [Edit on GitHub]

_OMEGA: real = 3.30000000E-001

range separation parameter [Edit on GitHub]