fix_modify AtC consistent_fe_initialization

syntax

fix_modify AtC consistent_fe_initialization <on | off>

• <on|off> = switch to activiate/deactiviate the intial setting of FE intrinsic field to match the projected MD field

examples

fix_modify atc consistent_fe_initialization on

description

Determines whether AtC initializes FE intrinsic fields (e.g., temperature) to match the projected MD values. This is particularly useful for fully overlapping simulations.

restrictions

Can be used with: thermal, two_temperature. Cannot be used with time filtering on. Does not include boundary nodes.

related

default

Default is off