fix check/timestep/gran command — LIGGGHTS v3.X documentation

# fix check/timestep/gran command

## Syntax

- fix ID group-ID check/timestep/gran nevery fraction_r fraction_h keywords vales:pre ID, group-ID are documented in fix command
- check/timestep/gran = style name of this fix command
- nevery = evaluate time-step size accuracy every this many time-steps
- fraction_r = warn if time-step size exceeds this fraction of the Rayleigh time
- fraction_h = warn if time-step size exceeds this fraction of the Hertz time
- zero or more keyword/value pairs may be appended
- keyword = warn or error or vmax

    warn value = yes or no
    error value = yes or no
    vmax value = v_max
      v_max = maximum particle velocity to be used as minimum for evaluation Hertz criterion

## Examples

    fix ts_check all check/timestep/gran 1000 0.1 0.1

## Description

Periodically calculate estimations of the Rayleigh- and Hertz time dt_r and dt_h for a granular system every ‘nevery’ time-steps. The user can specify two quantities fraction_r and fraction_h. A warning message is printed if the time-step size as specified via the timestep command exceeds either of dt_r * fraction_r or dt_h * fraction_h.

The former quantity is :

dt_r = PI*r*sqrt(rho/G)/(0.1631*nu+0.8766),

where rho is particle density, G is the shear modulus and nu is Poisson’s ratio. The latter quantity is expressed by

dt_h = 2.87*(m_eff^2/(r_eff*Y_eff^2*v_max))^0.2.

The effective mass m_eff, the effective radius r_eff and the effective Young’s modulus Y_eff are as defined in pair gran. v_max is the maximum relative velocity, taking mesh movement into account. Please note that the Hertz criterion will also be used if you use a different granular pair style (e.g. Hooke). If keyword vmax is used, a user-defined maximum velocity is used as a minimum in the formula above, i.e. the maximum of v_max of the particles in the simulation and v_max specified by the user is used.

Additionally, this command checks the ratio of skin to the distance that particles can travel relative to each other in one time-step. This value should be >1, otherwise some interactions may be missed or overlap energy may be generated artificially. This command will warn you if this is the case.

These criteria are checked every ‘nevery’ time-steps. Rayleigh time dt_r is calculated for each particle in the simulation, and the minimum value is taken for further calculations. Hertz time dt_h is estimated by testing a collision of each particle with itself using v_max as the assumed collision velocity.

Keyword warn can be used to turn off the warning message. Keyword error can be used to have LIGGGHTS(R)-PUBLIC issue an error message and abort the simulation if any of the criteria is violated.

## Restart, fix_modify, output, run start/stop, minimize info

No information about this fix is written to binary restart files. None of the fix_modify options are relevant to this fix. This fix computes a 3-vector, for access by various output commands. The vector consists of the time-step size expressed as fraction of the Rayleigh and Hertz time-step sizes and the ratio of skin to the distance particles can travel relative to each other in one time-step, respectively. No parameter of this fix can be used with the start/stop keywords of the run command. This fix is not invoked during `energy minimization`.

## Restrictions

> none

Related commands: none

Default: warn = yes, error = no, v_max = 0