FBIAS_A
FBIAS_A = [real (array)]
Description: Defines the step height for the bias potential in .
FBIAS_A defines the height of the step () in the Fermi-like step-shaped bias potential of the following form:
where the sum runs over all () coordinates the potential acts upon, which are defined in the ICONST file by setting the status
to 4.
The units of are .
The number of items defined via FBIAS_A must be equal to , otherwise the calculation terminates with an error message.
Related tags and articles
FBIAS_R0, FBIAS_D, ICONST, Biased molecular dynamics