Difference between revisions of "Eph groupID"
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(Created page with "<code>eph_groupID</code> sets the group of atoms for which the nonadiabatic_processes will be applied during the simulation. === Summary === {| class="wikitable" |+ Summa...") |
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=== Example === | === Example === | ||
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[[nonadiabatic_processes]] = .true. | [[nonadiabatic_processes]] = .true. | ||
| − | [[eph_groupID]] = | + | [[eph_groupID]] = all |
Latest revision as of 14:33, 6 November 2023
eph_groupID sets the group of atoms for which the nonadiabatic_processes will be applied during the simulation.
Summary
| Required/optional | Type | Accepted values | Default | See also |
|---|---|---|---|---|
| Optional | String | Any valid group ID | all (for all atoms) | nonadiabatic_processes, adapt_time_groupID, eel_groupID, thermostat_groupID, optimize_groupID, make_group
|
Example
nonadiabatic_processes = .true. eph_groupID = all
