HILLS_BIN

From VASP Wiki

HILLS_BIN = [Integer]
Default: HILLS_BIN = NSW 

Description: HILLS_BIN sets the number of steps after which the bias potential is updated in a metadynamics run (in case VASP was compiled with -Dtbdyn).


In metadynamics (MDALGO=11 | 21), the bias potential is given as

Thre parameters (HILLS_H, HILLS_W, and HILLS_BIN) must be provided by the user.


The number of steps after which the bias potential is updated is set by HILLS_BIN.

Related tags and articles

Metadynamics, HILLS_H, HILLS_W, MDALGO

Examples that use this tag