HFXLR

Uses the HFXLR (long range) kernel [Edit on GitHub]

Keywords

• RCUT

• SCALE

Keyword descriptions

RCUT

Type: real
Default: 6.00000000E+000 [bohr]
Usage: RCUT 5.00

Description: Value of lower range cutoff of interaction [Bohr]

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SCALE

Type: real
Default: 1.00000000E+000
Usage: SCALE 0.25

Description: Scaling parameter for HFX kernel.

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