\(\renewcommand{\AA}{\text{Å}}\)
fix_modify AtC filter command
Syntax
fix_modify <AtC fixID> filter <on|off|equilibrate>
AtC fixID = ID of fix atc instance
filter = name of the AtC sub-command
on or off or equilibrate = Select state of filter
Examples
fix_modify AtC filter on
Description
Filters the MD dynamics to construct a more appropriate continuous field. Equilibrating first filters the time derivatives without changing the dynamics to provide a better initial condition to the filtered dynamics.
Restrictions
Only for use with these specific transfers: thermal, two_temperature
Default
off