DAMPING

Section can be repeated.

This section specifies optional electric field damping for the polarizable atoms. [Edit on GitHub]

Keywords

• ATOM

• BIJ

• CIJ

• ORDER

• TYPE

Keyword descriptions

ATOM

Type: string
Usage: ATOM {KIND1}

Description: Defines the atomic kind for this damping function.

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BIJ

Type: real
Default: [angstrom^-1]
Usage: BIJ {real}

Description: Defines the BIJ parameter for this damping.

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CIJ

Type: real
Usage: CIJ {real}

Description: Defines the CIJ parameter for this damping.

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ORDER

Type: integer
Default: 3
Usage: ORDER {integer}

Description: Defines the order for this damping.

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TYPE

Type: string
Default: TANG-TOENNIES
Usage: TYPE {string}

Description: Defines the damping type.

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