Action: ECV_LINEAR
| Module | opes |
|---|---|
| Description | Usage |
| Linear expansion, according to a parameter lambda. |   |
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 | scalar | the label of the Hamiltonian difference |
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 of the Hamiltonian difference |
| TEMP | compulsory | -1 | temperature |
| LAMBDA | compulsory | 0 | the lambda at which the underlying simulation runs |
| NUMERICAL_DERIVATIVES | optional | false | calculate the derivatives for these quantities numerically |
| LAMBDA_MIN | optional | not used | the minimum of the lambda range |
| LAMBDA_MAX | optional | not used | the maximum of the lambda range |
| LAMBDA_STEPS | optional | not used | uniformly place the lambda values, for a total of LAMBDA_STEPS |
| LAMBDA_SET_ALL | optional | not used | manually set all the lamdbas |
| DIMENSIONLESS | optional | false | ARG is considered dimensionless rather than an energy, thus is not multiplied by beta |
| GEOM_SPACING | optional | false | use geometrical spacing in lambda instead of linear spacing |