Action: DUMPCUBE
| Module | gridtools |
|---|---|
| Description | Usage |
| Output a three dimensional grid using the Gaussian cube file format. | |
| This action outputs data to a file. You can read more about how PLUMED manages output files here |
Input
The arguments that serve as the input for this action are specified using one or more of the keywords in the following table.
| Keyword | Type | Description |
|---|---|---|
| ARG | grid | the label for the grid that you would like to output |
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 |
|---|---|---|---|
| ARG | input | none | the label for the grid that you would like to output |
| STRIDE | compulsory | 0 | the frequency with which the grid should be output to the file |
| FILE | compulsory | density | the file on which to write the grid |
| GRID | optional | not used | the grid you would like to print (can also use ARG for specifying what is being printed) |
| FMT | optional | not used | the format that should be used to output real numbers |
| PRINT_XYZ | optional | false | output coordinates on fibonacci grid to xyz file |
| PRINT_ONE_FILE | optional | false | output grids one after the other in a single file |