Action: FIXEDATOM
Module | vatom |
---|---|
Description | Usage |
Add a virtual atom in a fixed position. | |
This action outputs data to a file. You can read more about how PLUMED manages output files here |
Input
The atoms that serve as the input for this action are specified using one or more of the keywords in the following table.
Keyword | Type | Description |
---|---|---|
ATOMS | atoms | the list of atoms which are involved the virtual atom’s definition |
Further details and examples
Text from manual goes here
Syntax
The following table describes the keywords and options that can be used with this action
Keyword | Type | Default | Description |
---|---|---|---|
ATOMS | input | none | the list of atoms which are involved the virtual atom’s definition |
AT | compulsory | none | coordinates of the virtual atom |
SET_MASS | compulsory | 1 | mass of the virtual atom |
SET_CHARGE | compulsory | 0 | charge of the virtual atom |
SCALED_COMPONENTS | optional | false | use scaled components |