Difference between revisions of "Adapt tstep interval"
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(Created page with "<code>adapt_tstep_interval</code> sets the interval of MD steps at which the adaptive time algorithm will be called to check if the current time-step is according to the speci...") |
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| − | |+ Summary for <code> | + | |+ Summary for <code>adapt_tstep_interval</code> keyword |
! style="text-align:left;"| Required/optional | ! style="text-align:left;"| Required/optional | ||
! style="text-align:left;"| Type | ! style="text-align:left;"| Type | ||
Revision as of 09:48, 27 September 2023
adapt_tstep_interval sets the interval of MD steps at which the adaptive time algorithm will be called to check if the current time-step is according to the specified maximum allowed displacement adapt_xmax and maximum allowed energy transfer adapt_emax per time-step criteria.
Summary
| Required/optional | Type | Accepted values | Default | See also | Remarks |
|---|---|---|---|---|---|
| Required | Integer | Any integer | 1 | adaptive_time, adapt_tmin, adapt_tmax, adapt_xmax, adapt_emax
|
Optimum interval which is neither too frequent nor too infrequent should be used. |
