ESPResSo
Extensible Simulation Package for Research on Soft Matter Systems
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BMHTF_Parameters Struct Reference

BMHTF NaCl potential. More...

#include <nonbonded_interaction_data.hpp>

Public Member Functions

 BMHTF_Parameters ()=default
 
 BMHTF_Parameters (double A, double B, double C, double D, double sig, double cut)
 
double max_cutoff () const
 

Public Attributes

double A = 0.0
 
double B = 0.0
 
double C = 0.0
 
double D = 0.0
 
double sig = 0.0
 
double cut = INACTIVE_CUTOFF
 
double computed_shift = 0.0
 

Detailed Description

BMHTF NaCl potential.

Definition at line 142 of file nonbonded_interaction_data.hpp.

Constructor & Destructor Documentation

◆ BMHTF_Parameters() [1/2]

BMHTF_Parameters::BMHTF_Parameters ( )
default

◆ BMHTF_Parameters() [2/2]

BMHTF_Parameters::BMHTF_Parameters ( double  A,
double  B,
double  C,
double  D,
double  sig,
double  cut 
)

Definition at line 34 of file bmhtf-nacl.cpp.

References A, B, C, computed_shift, cut, D, and sig.

Member Function Documentation

◆ max_cutoff()

double BMHTF_Parameters::max_cutoff ( ) const
inline

Definition at line 153 of file nonbonded_interaction_data.hpp.

References cut.

Referenced by recalc_maximal_cutoff().

Member Data Documentation

◆ A

◆ B

◆ C

◆ computed_shift

double BMHTF_Parameters::computed_shift = 0.0

Definition at line 149 of file nonbonded_interaction_data.hpp.

Referenced by BMHTF_pair_energy(), and BMHTF_Parameters().

◆ cut

◆ D

◆ sig


The documentation for this struct was generated from the following files: