Difference between revisions of "Eph betafile"
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(Created page with "<code>eph_betafile</code> takes the name of the file containing the electronic stopping coupling parameter. This file has standard format. In case there are multiple elements...") |
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| 'NULL' | | 'NULL' | ||
| <code>[[electronic_stopping]]</code>, <code>[[estop_filename]]</code>, <code>[[nonadiabatic_processes]]</code> | | <code>[[electronic_stopping]]</code>, <code>[[estop_filename]]</code>, <code>[[nonadiabatic_processes]]</code> | ||
| − | | A coupling parameter file must be provided. | + | | A coupling parameter file must be provided when invoking this method in MD simulation. |
|} | |} | ||
Revision as of 11:20, 28 September 2023
eph_betafile takes the name of the file containing the electronic stopping coupling parameter. This file has standard format. In case there are multiple elements in the target material, the data corresponding to each element should be in order the elements are named in the species input keyword.
Summary
| Required/optional | Type | Accepted values | Default | See also | Remarks |
|---|---|---|---|---|---|
| Required | String | Short file names | 'NULL' | electronic_stopping, estop_filename, nonadiabatic_processes
|
A coupling parameter file must be provided when invoking this method in MD simulation. |
