New options adaptstep and halfstepback in adaptglok. Adapted documentation.

This commit is contained in:
Julien Guénolé
2017-08-04 16:43:23 +02:00
parent f9315a7ad9
commit bf85b04aaf
5 changed files with 36 additions and 12 deletions

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@ -63,6 +63,8 @@ class Min : protected Pointers {
double alpha0,alpha_shrink; // mixing velocities+forces coefficient (adaptglok)
double tmax,tmin; // timestep max, min (adaptglok)
int integrator; // choose the style of time integrator (adaptglok)
int halfstepback_flag; // 1: half step backward when v.f <= 0.0 (adaptglok)
int adaptstep_flag; // 1: variable timestep, 0: constant (adaptglok)
int nelist_global,nelist_atom; // # of PE,virial computes to check
int nvlist_global,nvlist_atom;